5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide

C11H13N5O — CID 63722688

IUPAC5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
SMILESCn1ccc(NC(=O)c2ccc(CN)cn2)n1
InChIInChI=1S/C11H13N5O/c1-16-5-4-10(15-16)14-11(17)9-3-2-8(6-12)7-13-9/h2-5,7H,6,12H2,1H3,(H,14,15,17)
InChIKeyVWMAWWLJWGGVCR-UHFFFAOYSA-N
MW231.26 g/mol
LogP0.53
Rot. Bonds3

About 5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide

5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide (PubChem CID 63722688) has the molecular formula C11H13N5O and a molecular weight of 231.26 g/mol. Its IUPAC name is 5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
PubChem CID63722688
Molecular FormulaC11H13N5O
Molecular Weight231.26 g/mol
Exact Mass231.11
IUPAC Name5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
SMILESCn1ccc(NC(=O)c2ccc(CN)cn2)n1
InChIInChI=1S/C11H13N5O/c1-16-5-4-10(15-16)14-11(17)9-3-2-8(6-12)7-13-9/h2-5,7H,6,12H2,1H3,(H,14,15,17)
InChIKeyVWMAWWLJWGGVCR-UHFFFAOYSA-N
XLogP0.53
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.26
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(methylamino)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
CID 104640352
5-hydrazinyl-N-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide
CID 107377514
5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide
CID 63722350
5-chloro-N-(1-methylpyrazol-3-yl)furan-2-carboxamide
CID 51237986
6-(ethylamino)-N-(1-methylpyrazol-3-yl)pyridazine-3-carboxamide
CID 62180741
5-(aminomethyl)-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide
CID 63724718
1-benzyl-N-(1-methylpyrazol-3-yl)-6-oxopyridazine-3-carboxamide
CID 51237900
5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide
CID 63724390
5-(3-chlorophenoxy)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
CID 166397540
5-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-2-carboxamide
CID 79351403
5-(aminomethyl)-N-(2-methyl-4-pyridinyl)pyridine-2-carboxamide
CID 79234754
5-(aminomethyl)-N-(3-methyl-4-pyridinyl)pyridine-2-carboxamide
CID 63723889

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide?
The IUPAC name of 5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide (CID 63722688) is 5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide?
The canonical SMILES for 5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide is Cn1ccc(NC(=O)c2ccc(CN)cn2)n1.
What is the InChIKey of 5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide?
The InChIKey is VWMAWWLJWGGVCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O/c1-16-5-4-10(15-16)14-11(17)9-3-2-8(6-12)7-13-9/h2-5,7H,6,12H2,1H3,(H,14,15,17).
What are the key properties of 5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide?
5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide has a molecular weight of 231.26 g/mol, XLogP of 0.53, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide is sourced from PubChem (CID 63722688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).