NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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5-amino-3-methyl-1H-pyrazole-4-carbonitrile
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3-amino-5-methyl-1H-pyrazole-4-carbonitrile
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IUPAC Traditional name
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3-amino-5-methyl-2H-pyrazole-4-carbonitrile
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3-amino-5-methyl-1H-pyrazole-4-carbonitrile
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Synonyms
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5-Amino-3-methyl-1H-pyrazole-4-carbonitrile
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5-Amino-3-methyl-1H-pyrazole-4-carbonitrile
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3-AMINO-5-METHYL-1H-PYRAZOLE-4-CARBONITRILE
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CAS Number
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MDL Number
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MFCD00128276
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MFCD02020550
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PubChem SID
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PubChem CID
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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14.786096
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H Acceptors
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3
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H Donor
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2
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LogD (pH = 5.5)
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0.09409531
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LogD (pH = 7.4)
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0.09856164
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Log P
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0.098618895
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Molar Refractivity
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35.6306 cm3
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Polarizability
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11.8970375 Å3
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Polar Surface Area
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78.49 Å2
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Rotatable Bonds
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0
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Lipinski's Rule of Five
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true
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PATENTS
PATENTS
PubChem Patent
Google Patent