N-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide

C15H19N5O — CID 104641173

IUPACN-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccc(C(=O)NCc2cnc(C)cn2)nc1
InChIInChI=1S/C15H19N5O/c1-3-6-16-12-4-5-14(19-8-12)15(21)20-10-13-9-17-11(2)7-18-13/h4-5,7-9,16H,3,6,10H2,1-2H3,(H,20,21)
InChIKeyYWKTYWAXVJCXOD-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.93
Rot. Bonds6

About N-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide

N-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide (PubChem CID 104641173) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is N-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide
PubChem CID104641173
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC NameN-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccc(C(=O)NCc2cnc(C)cn2)nc1
InChIInChI=1S/C15H19N5O/c1-3-6-16-12-4-5-14(19-8-12)15(21)20-10-13-9-17-11(2)7-18-13/h4-5,7-9,16H,3,6,10H2,1-2H3,(H,20,21)
InChIKeyYWKTYWAXVJCXOD-UHFFFAOYSA-N
XLogP1.93
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(methylamino)-N-[(5-methylpyrazin-2-yl)methyl]pyridine-2-carboxamide
CID 104641171
5-bromo-N-[(5-methylpyrazin-2-yl)methyl]pyridine-2-carboxamide
CID 62954782
N-[(4,5-dimethylthiophen-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide
CID 104641591
N-[(5-methylpyrazin-2-yl)methyl]-2-(propylamino)benzamide
CID 62841224
5-(propylamino)-N-(1H-pyrazol-4-ylmethyl)pyridine-2-carboxamide
CID 104641010
N-[(2-chlorophenyl)methyl]-5-(propylamino)pyridine-2-carboxamide
CID 109179268
N-[(3-fluorophenyl)methyl]-5-(propylamino)pyridine-2-carboxamide
CID 104640089
N-(2-propan-2-yloxyethyl)-5-(propylamino)pyridine-2-carboxamide
CID 104765582
5-methyl-N-propylpyrazine-2-carboxamide
CID 60637750
4-amino-N-[(5-methylpyrazin-2-yl)methyl]-2-(propylamino)-1,3-thiazole-5-carboxamide
CID 116665607
5-(propylamino)-N-thiophen-3-ylpyridine-2-carboxamide
CID 104641679
5-hydrazinyl-N-propylpyridine-2-carboxamide
CID 104642261

Frequently Asked Questions

What is the IUPAC name of N-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide?
The IUPAC name of N-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide (CID 104641173) is N-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide?
The canonical SMILES for N-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide is CCCNc1ccc(C(=O)NCc2cnc(C)cn2)nc1.
What is the InChIKey of N-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide?
The InChIKey is YWKTYWAXVJCXOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-3-6-16-12-4-5-14(19-8-12)15(21)20-10-13-9-17-11(2)7-18-13/h4-5,7-9,16H,3,6,10H2,1-2H3,(H,20,21).
What are the key properties of N-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide?
N-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 1.93, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methylpyrazin-2-yl)methyl]-5-(propylamino)pyridine-2-carboxamide is sourced from PubChem (CID 104641173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).