5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide

C11H11N5O — CID 63722350

IUPAC5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide
SMILESNCc1ccc(C(=O)Nc2cnccn2)nc1
InChIInChI=1S/C11H11N5O/c12-5-8-1-2-9(15-6-8)11(17)16-10-7-13-3-4-14-10/h1-4,6-7H,5,12H2,(H,14,16,17)
InChIKeyLEYNTQVVSRAHNS-UHFFFAOYSA-N
MW229.24 g/mol
LogP0.58
Rot. Bonds3

About 5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide

5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide (PubChem CID 63722350) has the molecular formula C11H11N5O and a molecular weight of 229.24 g/mol. Its IUPAC name is 5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide
PubChem CID63722350
Molecular FormulaC11H11N5O
Molecular Weight229.24 g/mol
Exact Mass229.10
IUPAC Name5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide
SMILESNCc1ccc(C(=O)Nc2cnccn2)nc1
InChIInChI=1S/C11H11N5O/c12-5-8-1-2-9(15-6-8)11(17)16-10-7-13-3-4-14-10/h1-4,6-7H,5,12H2,(H,14,16,17)
InChIKeyLEYNTQVVSRAHNS-UHFFFAOYSA-N
XLogP0.58
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(aminomethyl)-N-(3-methyl-4-pyridinyl)pyridine-2-carboxamide
CID 63723889
5-(aminomethyl)-N-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
CID 63722688
5-(aminomethyl)-N-(2-methyl-4-pyridinyl)pyridine-2-carboxamide
CID 79234754
4-amino-N-pyrazin-2-ylbenzamide
CID 43616023
5-(aminomethyl)-N-benzylpyridine-2-carboxamide
CID 55230776
5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide
CID 63724390
N-[[4-(aminomethyl)phenyl]methyl]pyrazin-2-amine
CID 60918656
5-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-2-carboxamide
CID 79351403
2-methyl-6-(pyrazin-2-ylcarbamoyl)pyridine-3-carboxylic acid
CID 43616230
5-(aminomethyl)-N-(2,3-difluorophenyl)pyridine-2-carboxamide
CID 55229818
4-hydroxy-N-pyrazin-2-ylbenzamide
CID 43422735
5-(aminomethyl)-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide
CID 63724718

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide?
The IUPAC name of 5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide (CID 63722350) is 5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide.
What is the SMILES notation for 5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide?
The canonical SMILES for 5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide is NCc1ccc(C(=O)Nc2cnccn2)nc1.
What is the InChIKey of 5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide?
The InChIKey is LEYNTQVVSRAHNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5O/c12-5-8-1-2-9(15-6-8)11(17)16-10-7-13-3-4-14-10/h1-4,6-7H,5,12H2,(H,14,16,17).
What are the key properties of 5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide?
5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide has a molecular weight of 229.24 g/mol, XLogP of 0.58, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-pyrazin-2-ylpyridine-2-carboxamide is sourced from PubChem (CID 63722350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).