7-amino-4-methyl-1H-1,8-naphthyridin-2-one

C9H9N3O — CID 5354050

IUPAC7-amino-4-methyl-1H-1,8-naphthyridin-2-one
SMILESCc1cc(=O)[nH]c2nc(N)ccc12
InChIInChI=1S/C9H9N3O/c1-5-4-8(13)12-9-6(5)2-3-7(10)11-9/h2-4H,1H3,(H3,10,11,12,13)
InChIKeyURBSEJOKAKIABF-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.81
Rot. Bonds

About 7-amino-4-methyl-1H-1,8-naphthyridin-2-one

7-amino-4-methyl-1H-1,8-naphthyridin-2-one (PubChem CID 5354050) has the molecular formula C9H9N3O and a molecular weight of 175.19 g/mol. Its IUPAC name is 7-amino-4-methyl-1H-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name7-amino-4-methyl-1H-1,8-naphthyridin-2-one
PubChem CID5354050
Molecular FormulaC9H9N3O
Molecular Weight175.19 g/mol
Exact Mass175.07
IUPAC Name7-amino-4-methyl-1H-1,8-naphthyridin-2-one
SMILESCc1cc(=O)[nH]c2nc(N)ccc12
InChIInChI=1S/C9H9N3O/c1-5-4-8(13)12-9-6(5)2-3-7(10)11-9/h2-4H,1H3,(H3,10,11,12,13)
InChIKeyURBSEJOKAKIABF-UHFFFAOYSA-N
XLogP0.81
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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N-(4,6-dimethyl-2-pyridinyl)benzamide
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2-Acetamido-6-methylpyridine
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7-Amino-1,8-naphthyridin-2(1H)-one
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Frequently Asked Questions

What is the IUPAC name of 7-amino-4-methyl-1H-1,8-naphthyridin-2-one?
The IUPAC name of 7-amino-4-methyl-1H-1,8-naphthyridin-2-one (CID 5354050) is 7-amino-4-methyl-1H-1,8-naphthyridin-2-one.
What is the SMILES notation for 7-amino-4-methyl-1H-1,8-naphthyridin-2-one?
The canonical SMILES for 7-amino-4-methyl-1H-1,8-naphthyridin-2-one is Cc1cc(=O)[nH]c2nc(N)ccc12.
What is the InChIKey of 7-amino-4-methyl-1H-1,8-naphthyridin-2-one?
The InChIKey is URBSEJOKAKIABF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O/c1-5-4-8(13)12-9-6(5)2-3-7(10)11-9/h2-4H,1H3,(H3,10,11,12,13).
What are the key properties of 7-amino-4-methyl-1H-1,8-naphthyridin-2-one?
7-amino-4-methyl-1H-1,8-naphthyridin-2-one has a molecular weight of 175.19 g/mol, XLogP of 0.81, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-4-methyl-1H-1,8-naphthyridin-2-one is sourced from PubChem (CID 5354050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).