2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one

C12H14N2O — CID 147727111

IUPAC2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one
SMILESCC(C)c1cn(C)c(=O)c2ccncc12
InChIInChI=1S/C12H14N2O/c1-8(2)11-7-14(3)12(15)9-4-5-13-6-10(9)11/h4-8H,1-3H3
InChIKeyGXRYYEGSIVEVMU-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.06
Rot. Bonds1

About 2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one

2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one (PubChem CID 147727111) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one.

Molecular Properties

Compound Name2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one
PubChem CID147727111
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one
SMILESCC(C)c1cn(C)c(=O)c2ccncc12
InChIInChI=1S/C12H14N2O/c1-8(2)11-7-14(3)12(15)9-4-5-13-6-10(9)11/h4-8H,1-3H3
InChIKeyGXRYYEGSIVEVMU-UHFFFAOYSA-N
XLogP2.06
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one?
The IUPAC name of 2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one (CID 147727111) is 2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one.
What is the SMILES notation for 2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one?
The canonical SMILES for 2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one is CC(C)c1cn(C)c(=O)c2ccncc12.
What is the InChIKey of 2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one?
The InChIKey is GXRYYEGSIVEVMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-8(2)11-7-14(3)12(15)9-4-5-13-6-10(9)11/h4-8H,1-3H3.
What are the key properties of 2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one?
2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one has a molecular weight of 202.26 g/mol, XLogP of 2.06, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-propan-2-yl-2,6-naphthyridin-1-one is sourced from PubChem (CID 147727111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).