4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide

C17H17N7O2 — CID 167849051

IUPAC4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide
SMILESO=C(Nc1n[nH]c(-c2ccccn2)n1)c1cc(N2CCOCC2)ccn1
InChIInChI=1S/C17H17N7O2/c25-16(14-11-12(4-6-19-14)24-7-9-26-10-8-24)21-17-20-15(22-23-17)13-3-1-2-5-18-13/h1-6,11H,7-10H2,(H2,20,21,22,23,25)
InChIKeyFOEKAGCOCSZOFP-UHFFFAOYSA-N
MW351.37 g/mol
LogP1.35
Rot. Bonds4

About 4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide

4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide (PubChem CID 167849051) has the molecular formula C17H17N7O2 and a molecular weight of 351.37 g/mol. Its IUPAC name is 4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide
PubChem CID167849051
Molecular FormulaC17H17N7O2
Molecular Weight351.37 g/mol
Exact Mass351.14
IUPAC Name4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide
SMILESO=C(Nc1n[nH]c(-c2ccccn2)n1)c1cc(N2CCOCC2)ccn1
InChIInChI=1S/C17H17N7O2/c25-16(14-11-12(4-6-19-14)24-7-9-26-10-8-24)21-17-20-15(22-23-17)13-3-1-2-5-18-13/h1-6,11H,7-10H2,(H2,20,21,22,23,25)
InChIKeyFOEKAGCOCSZOFP-UHFFFAOYSA-N
XLogP1.35
TPSA108.92 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.37
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide with MolForge

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Related Compounds

4-morpholin-4-yl-N-[5-(trifluoromethyl)-1H-pyrazol-3-yl]pyridine-2-carboxamide
CID 136564579
N-(3-acetylphenyl)-4-morpholin-4-ylpyridine-2-carboxamide
CID 109206676
4-morpholin-4-yl-N-(2-phenylethyl)pyridine-2-carboxamide
CID 109206585
N-(4-cyclopropyl-1,3-thiazol-2-yl)-4-morpholin-4-ylpyridine-2-carboxamide
CID 91650779
4-(4-methylpiperazin-1-yl)-N-(2-morpholin-4-ylphenyl)pyridine-2-carboxamide
CID 109208362
4-methyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide
CID 86992065
N-[2-(3-morpholin-4-ylphenyl)-1H-benzimidazol-4-yl]pyridine-2-carboxamide
CID 58279364
N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-morpholin-4-ylpyridine-2-carboxamide
CID 9456512
N-(2-methylpropyl)-4-morpholin-4-ylpyridine-2-carboxamide
CID 109202858
N-[4-(4-methylpiperidin-1-yl)phenyl]-4-morpholin-4-ylpyridine-2-carboxamide
CID 109206689
5-bromo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide
CID 86992070
N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CID 51096870

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide?
The IUPAC name of 4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide (CID 167849051) is 4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide.
What is the SMILES notation for 4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide?
The canonical SMILES for 4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide is O=C(Nc1n[nH]c(-c2ccccn2)n1)c1cc(N2CCOCC2)ccn1.
What is the InChIKey of 4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide?
The InChIKey is FOEKAGCOCSZOFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N7O2/c25-16(14-11-12(4-6-19-14)24-7-9-26-10-8-24)21-17-20-15(22-23-17)13-3-1-2-5-18-13/h1-6,11H,7-10H2,(H2,20,21,22,23,25).
What are the key properties of 4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide?
4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide has a molecular weight of 351.37 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyridine-2-carboxamide is sourced from PubChem (CID 167849051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).