3,7-dimethyl-2,7-naphthyridin-1-one

C10H10N2O — CID 71367861

IUPAC3,7-dimethyl-2,7-naphthyridin-1-one
SMILESCc1cc2ccn(C)cc-2c(=O)n1
InChIInChI=1S/C10H10N2O/c1-7-5-8-3-4-12(2)6-9(8)10(13)11-7/h3-6H,1-2H3
InChIKeyAFAPJDGZMJIGOW-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.19
Rot. Bonds

About 3,7-dimethyl-2,7-naphthyridin-1-one

3,7-dimethyl-2,7-naphthyridin-1-one (PubChem CID 71367861) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 3,7-dimethyl-2,7-naphthyridin-1-one.

Molecular Properties

Compound Name3,7-dimethyl-2,7-naphthyridin-1-one
PubChem CID71367861
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name3,7-dimethyl-2,7-naphthyridin-1-one
SMILESCc1cc2ccn(C)cc-2c(=O)n1
InChIInChI=1S/C10H10N2O/c1-7-5-8-3-4-12(2)6-9(8)10(13)11-7/h3-6H,1-2H3
InChIKeyAFAPJDGZMJIGOW-UHFFFAOYSA-N
XLogP1.19
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,7-dimethyl-2,7-naphthyridin-1-one?
The IUPAC name of 3,7-dimethyl-2,7-naphthyridin-1-one (CID 71367861) is 3,7-dimethyl-2,7-naphthyridin-1-one.
What is the SMILES notation for 3,7-dimethyl-2,7-naphthyridin-1-one?
The canonical SMILES for 3,7-dimethyl-2,7-naphthyridin-1-one is Cc1cc2ccn(C)cc-2c(=O)n1.
What is the InChIKey of 3,7-dimethyl-2,7-naphthyridin-1-one?
The InChIKey is AFAPJDGZMJIGOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-7-5-8-3-4-12(2)6-9(8)10(13)11-7/h3-6H,1-2H3.
What are the key properties of 3,7-dimethyl-2,7-naphthyridin-1-one?
3,7-dimethyl-2,7-naphthyridin-1-one has a molecular weight of 174.20 g/mol, XLogP of 1.19, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dimethyl-2,7-naphthyridin-1-one is sourced from PubChem (CID 71367861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).