1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide

C10H12N6O — CID 107542386

IUPAC1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide
SMILESCc1cc(CN)nc(-n2ccc(C(N)=O)n2)n1
InChIInChI=1S/C10H12N6O/c1-6-4-7(5-11)14-10(13-6)16-3-2-8(15-16)9(12)17/h2-4H,5,11H2,1H3,(H2,12,17)
InChIKeyCWDNZVXBSCGFFB-UHFFFAOYSA-N
MW232.25 g/mol
LogP-0.47
Rot. Bonds3

About 1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide

1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide (PubChem CID 107542386) has the molecular formula C10H12N6O and a molecular weight of 232.25 g/mol. Its IUPAC name is 1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide.

Molecular Properties

Compound Name1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide
PubChem CID107542386
Molecular FormulaC10H12N6O
Molecular Weight232.25 g/mol
Exact Mass232.11
IUPAC Name1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide
SMILESCc1cc(CN)nc(-n2ccc(C(N)=O)n2)n1
InChIInChI=1S/C10H12N6O/c1-6-4-7(5-11)14-10(13-6)16-3-2-8(15-16)9(12)17/h2-4H,5,11H2,1H3,(H2,12,17)
InChIKeyCWDNZVXBSCGFFB-UHFFFAOYSA-N
XLogP-0.47
TPSA112.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.25
LogP ≤ 5-0.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-[5-(aminomethyl)-2-methylphenyl]pyrazole-3-carboxamide
CID 105406365
1-[6-(aminomethyl)-3-pyridinyl]pyrazole-3-carboxamide
CID 115487131
1-[2-(aminomethyl)-6-methylphenyl]pyrazole-3-carboxamide
CID 107105885
1-(6-amino-2-methylpyrimidin-4-yl)pyrazole-3-carboxamide
CID 80867928
1-[2-(aminomethyl)phenyl]pyrazole-3-carboxamide
CID 64782828
1-(3-carbamothioyl-6-methyl-2-pyridinyl)pyrazole-3-carboxamide
CID 64782845
1-[4-(aminomethyl)-3-bromophenyl]pyrazole-3-carboxamide
CID 107275115
1-(4,6-dimethylpyrimidin-2-yl)pyrazol-3-amine
CID 57289097
1-(4-amino-6-imidazol-1-yl-1,3,5-triazin-2-yl)pyrazole-3-carboxamide
CID 80868519
1-[4-methoxy-6-(propylamino)-1,3,5-triazin-2-yl]pyrazole-3-carboxamide
CID 80868762
1-[4-imidazol-1-yl-6-(methylamino)-1,3,5-triazin-2-yl]pyrazole-3-carboxamide
CID 80843144
6-methyl-2-(3-methylpyrazol-1-yl)pyrimidin-4-amine
CID 82404538

Frequently Asked Questions

What is the IUPAC name of 1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide?
The IUPAC name of 1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide (CID 107542386) is 1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide.
What is the SMILES notation for 1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide?
The canonical SMILES for 1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide is Cc1cc(CN)nc(-n2ccc(C(N)=O)n2)n1.
What is the InChIKey of 1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide?
The InChIKey is CWDNZVXBSCGFFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6O/c1-6-4-7(5-11)14-10(13-6)16-3-2-8(15-16)9(12)17/h2-4H,5,11H2,1H3,(H2,12,17).
What are the key properties of 1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide?
1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide has a molecular weight of 232.25 g/mol, XLogP of -0.47, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(aminomethyl)-6-methylpyrimidin-2-yl]pyrazole-3-carboxamide is sourced from PubChem (CID 107542386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).