1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one

C15H18N2O — CID 139602599

IUPAC1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one
SMILESCCC=CCCn1c(=O)ccc2cc(C)cnc21
InChIInChI=1S/C15H18N2O/c1-3-4-5-6-9-17-14(18)8-7-13-10-12(2)11-16-15(13)17/h4-5,7-8,10-11H,3,6,9H2,1-2H3
InChIKeyHLYZATVSARALOQ-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.06
Rot. Bonds4

About 1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one

1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one (PubChem CID 139602599) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one
PubChem CID139602599
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one
SMILESCCC=CCCn1c(=O)ccc2cc(C)cnc21
InChIInChI=1S/C15H18N2O/c1-3-4-5-6-9-17-14(18)8-7-13-10-12(2)11-16-15(13)17/h4-5,7-8,10-11H,3,6,9H2,1-2H3
InChIKeyHLYZATVSARALOQ-UHFFFAOYSA-N
XLogP3.06
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Propiram
CID 26216
N-(pyridin-2-yl)prop-2-enamide
CID 9920419
3-Hydroxy-1,2-dihydro-1,8-naphthyridin-2-one
CID 20317991
N-methyl-N-(pyridin-2-yl)acetamide
CID 3786664
N-benzyl-2,2-dimethyl-N-(pyridin-2-yl)propanamide
CID 1122454
8,9,10,11-tetrahydropyrido[2',3':4,5]pyrimido[1,2-a]azepin-5(7H)-one
CID 1472978
N-Cyclohexyl-1-butyl-1,8-naphthyridin-2(1H)-on-3-carboxamide
CID 44157661
(E)-N-(5-(3-oxo-3-(3-phenylpyrrolidin-1-yl)prop-1-en-1-yl)pyridin-2-yl)acetamide
CID 122243059
N-[2-(4-benzylpiperidin-1-yl)ethyl]-N-pyridin-2-ylpropanamide
CID 156782594
3,4-Dimethyl-1-pyridin-2-yl-pyrrole-2,5-dione
CID 652349
(2E)-2-cyano-3-phenyl-N-(pyridin-2-yl)prop-2-enamide
CID 948676
2-Methyl-1-(4-(pyridin-2-yl)piperazin-1-yl)propan-1-one
CID 18340861

Frequently Asked Questions

What is the IUPAC name of 1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one?
The IUPAC name of 1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one (CID 139602599) is 1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one.
What is the SMILES notation for 1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one?
The canonical SMILES for 1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one is CCC=CCCn1c(=O)ccc2cc(C)cnc21.
What is the InChIKey of 1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one?
The InChIKey is HLYZATVSARALOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-3-4-5-6-9-17-14(18)8-7-13-10-12(2)11-16-15(13)17/h4-5,7-8,10-11H,3,6,9H2,1-2H3.
What are the key properties of 1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one?
1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one has a molecular weight of 242.32 g/mol, XLogP of 3.06, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hex-3-enyl-6-methyl-1,8-naphthyridin-2-one is sourced from PubChem (CID 139602599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).