N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide

C13H16N4O2 — CID 109223552

IUPACN-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2cncc(NC(C)C)c2)no1
InChIInChI=1S/C13H16N4O2/c1-8(2)15-11-5-10(6-14-7-11)13(18)16-12-4-9(3)19-17-12/h4-8,15H,1-3H3,(H,16,17,18)
InChIKeyQPCFSNAOOOKEBD-UHFFFAOYSA-N
MW260.30 g/mol
LogP2.45
Rot. Bonds4

About N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide

N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide (PubChem CID 109223552) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide
PubChem CID109223552
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2cncc(NC(C)C)c2)no1
InChIInChI=1S/C13H16N4O2/c1-8(2)15-11-5-10(6-14-7-11)13(18)16-12-4-9(3)19-17-12/h4-8,15H,1-3H3,(H,16,17,18)
InChIKeyQPCFSNAOOOKEBD-UHFFFAOYSA-N
XLogP2.45
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(3,5-dichloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109246348
5-(3,4-dimethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109243004
5-(2-methoxyethylamino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109228004
N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-2-carboxamide
CID 109179831
5-(2,6-diethylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109243974
N-(3-methylbutyl)-5-[(5-methyl-1,2-oxazol-3-yl)amino]pyridine-3-carboxamide
CID 109239896
5-(2-ethyl-6-methylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109243738
5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-(2-methylphenyl)pyridine-3-carboxamide
CID 109241732
N-(4-methoxyphenyl)-5-(propan-2-ylamino)pyridine-3-carboxamide
CID 109223486
N-(5-methyl-1,2-oxazol-3-yl)-5-(pyridin-3-ylmethylamino)pyridine-3-carboxamide
CID 109235488
3-N-benzyl-5-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3,5-dicarboxamide
CID 109105083
5-(propan-2-ylamino)pyridine-3-carboxylic acid
CID 79694248

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide (CID 109223552) is N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide is Cc1cc(NC(=O)c2cncc(NC(C)C)c2)no1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide?
The InChIKey is QPCFSNAOOOKEBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-8(2)15-11-5-10(6-14-7-11)13(18)16-12-4-9(3)19-17-12/h4-8,15H,1-3H3,(H,16,17,18).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide?
N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide has a molecular weight of 260.30 g/mol, XLogP of 2.45, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-5-(propan-2-ylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109223552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).