4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one

C17H23N3O2 — CID 175993677

IUPAC4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one
SMILESCOc1ccc2c(n1)c(N(C)C1CCCCC1)cc(=O)n2C
InChIInChI=1S/C17H23N3O2/c1-19(12-7-5-4-6-8-12)14-11-16(21)20(2)13-9-10-15(22-3)18-17(13)14/h9-12H,4-8H2,1-3H3
InChIKeyDLLSWKFHVXOBSD-UHFFFAOYSA-N
MW301.39 g/mol
LogP2.71
Rot. Bonds3

About 4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one

4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one (PubChem CID 175993677) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is 4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one.

Molecular Properties

Compound Name4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one
PubChem CID175993677
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC Name4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one
SMILESCOc1ccc2c(n1)c(N(C)C1CCCCC1)cc(=O)n2C
InChIInChI=1S/C17H23N3O2/c1-19(12-7-5-4-6-8-12)14-11-16(21)20(2)13-9-10-15(22-3)18-17(13)14/h9-12H,4-8H2,1-3H3
InChIKeyDLLSWKFHVXOBSD-UHFFFAOYSA-N
XLogP2.71
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one?
The IUPAC name of 4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one (CID 175993677) is 4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one.
What is the SMILES notation for 4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one?
The canonical SMILES for 4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one is COc1ccc2c(n1)c(N(C)C1CCCCC1)cc(=O)n2C.
What is the InChIKey of 4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one?
The InChIKey is DLLSWKFHVXOBSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-19(12-7-5-4-6-8-12)14-11-16(21)20(2)13-9-10-15(22-3)18-17(13)14/h9-12H,4-8H2,1-3H3.
What are the key properties of 4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one?
4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one has a molecular weight of 301.39 g/mol, XLogP of 2.71, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclohexyl(methyl)amino]-6-methoxy-1-methyl-1,5-naphthyridin-2-one is sourced from PubChem (CID 175993677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).