2-(methylamino)-7H-1,7-naphthyridin-8-one

C9H9N3O — CID 142879401

IUPAC2-(methylamino)-7H-1,7-naphthyridin-8-one
SMILESCNc1ccc2cc[nH]c(=O)c2n1
InChIInChI=1S/C9H9N3O/c1-10-7-3-2-6-4-5-11-9(13)8(6)12-7/h2-5H,1H3,(H,10,12)(H,11,13)
InChIKeyCTNIXCQHMBSABM-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.96
Rot. Bonds1

About 2-(methylamino)-7H-1,7-naphthyridin-8-one

2-(methylamino)-7H-1,7-naphthyridin-8-one (PubChem CID 142879401) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is 2-(methylamino)-7H-1,7-naphthyridin-8-one.

Molecular Properties

Compound Name2-(methylamino)-7H-1,7-naphthyridin-8-one
PubChem CID142879401
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC Name2-(methylamino)-7H-1,7-naphthyridin-8-one
SMILESCNc1ccc2cc[nH]c(=O)c2n1
InChIInChI=1S/C9H9N3O/c1-10-7-3-2-6-4-5-11-9(13)8(6)12-7/h2-5H,1H3,(H,10,12)(H,11,13)
InChIKeyCTNIXCQHMBSABM-UHFFFAOYSA-N
XLogP0.96
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

8-methoxy-N-methylquinolin-2-amine
CID 57292538
5-[2,6-difluoro-4-(2-hydroxypropan-2-yl)phenyl]-2-[(8-oxo-7H-1,7-naphthyridin-2-yl)amino]thiophene-3-carboxamide
CID 44555293
2,3-dimethoxy-6H-pyrido[3,4-b]pyrazin-5-one
CID 176774328
3-fluoro-7H-1,7-naphthyridin-8-one
CID 130866766
3-ethyl-2,6-dihydropyrazolo[3,4-c]pyridin-7-one
CID 15832608
8-oxo-N-[(2-oxo-1,5,6,7-tetrahydrocyclopenta[b]pyridin-3-yl)methyl]-7H-1,7-naphthyridine-2-carboxamide
CID 167865161
3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one
CID 70291895
1-(1H-pyrrolo[2,3-b]pyridin-6-yl)ethanone
CID 71743048
3-methyl-2,6-dihydropyrazolo[3,4-c]pyridin-7-one
CID 130251567
6-(methylamino)-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde
CID 119085910
5-[6-(methylamino)-1H-pyrrolo[2,3-b]pyridin-4-yl]-1H-pyrimidine-2,4-dione
CID 56916433
N-methyl-8-oxo-N-(3-pyrrolidin-1-ylpropyl)-7H-1,7-naphthyridine-2-carboxamide
CID 167772389

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-7H-1,7-naphthyridin-8-one?
The IUPAC name of 2-(methylamino)-7H-1,7-naphthyridin-8-one (CID 142879401) is 2-(methylamino)-7H-1,7-naphthyridin-8-one.
What is the SMILES notation for 2-(methylamino)-7H-1,7-naphthyridin-8-one?
The canonical SMILES for 2-(methylamino)-7H-1,7-naphthyridin-8-one is CNc1ccc2cc[nH]c(=O)c2n1.
What is the InChIKey of 2-(methylamino)-7H-1,7-naphthyridin-8-one?
The InChIKey is CTNIXCQHMBSABM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c1-10-7-3-2-6-4-5-11-9(13)8(6)12-7/h2-5H,1H3,(H,10,12)(H,11,13).
What are the key properties of 2-(methylamino)-7H-1,7-naphthyridin-8-one?
2-(methylamino)-7H-1,7-naphthyridin-8-one has a molecular weight of 175.19 g/mol, XLogP of 0.96, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-7H-1,7-naphthyridin-8-one is sourced from PubChem (CID 142879401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).