7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide

C12H10N6O2 — CID 60506748

IUPAC7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide
SMILESCc1ccc2c(=O)c(C(=O)Nc3ncn[nH]3)c[nH]c2n1
InChIInChI=1S/C12H10N6O2/c1-6-2-3-7-9(19)8(4-13-10(7)16-6)11(20)17-12-14-5-15-18-12/h2-5H,1H3,(H,13,16,19)(H2,14,15,17,18,20)
InChIKeySGKYGDXYAXNPRG-UHFFFAOYSA-N
MW270.25 g/mol
LogP0.60
Rot. Bonds2

About 7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide

7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide (PubChem CID 60506748) has the molecular formula C12H10N6O2 and a molecular weight of 270.25 g/mol. Its IUPAC name is 7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide
PubChem CID60506748
Molecular FormulaC12H10N6O2
Molecular Weight270.25 g/mol
Exact Mass270.09
IUPAC Name7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide
SMILESCc1ccc2c(=O)c(C(=O)Nc3ncn[nH]3)c[nH]c2n1
InChIInChI=1S/C12H10N6O2/c1-6-2-3-7-9(19)8(4-13-10(7)16-6)11(20)17-12-14-5-15-18-12/h2-5H,1H3,(H,13,16,19)(H2,14,15,17,18,20)
InChIKeySGKYGDXYAXNPRG-UHFFFAOYSA-N
XLogP0.60
TPSA116.42 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.25
LogP ≤ 50.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide (CID 60506748) is 7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide is Cc1ccc2c(=O)c(C(=O)Nc3ncn[nH]3)c[nH]c2n1.
What is the InChIKey of 7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide?
The InChIKey is SGKYGDXYAXNPRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N6O2/c1-6-2-3-7-9(19)8(4-13-10(7)16-6)11(20)17-12-14-5-15-18-12/h2-5H,1H3,(H,13,16,19)(H2,14,15,17,18,20).
What are the key properties of 7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide?
7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide has a molecular weight of 270.25 g/mol, XLogP of 0.60, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-4-oxo-N-(1H-1,2,4-triazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 60506748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).