2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one

C11H12N2O — CID 166583854

IUPAC2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one
SMILESC=CCN1CCc2ccncc2C1=O
InChIInChI=1S/C11H12N2O/c1-2-6-13-7-4-9-3-5-12-8-10(9)11(13)14/h2-3,5,8H,1,4,6-7H2
InChIKeyIWTDAJSJUUDQBC-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.27
Rot. Bonds2

About 2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one

2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one (PubChem CID 166583854) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one.

Molecular Properties

Compound Name2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one
PubChem CID166583854
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Name2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one
SMILESC=CCN1CCc2ccncc2C1=O
InChIInChI=1S/C11H12N2O/c1-2-6-13-7-4-9-3-5-12-8-10(9)11(13)14/h2-3,5,8H,1,4,6-7H2
InChIKeyIWTDAJSJUUDQBC-UHFFFAOYSA-N
XLogP1.27
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-prop-2-enyl-1H-pyrrolo[3,4-c]pyridin-3-one
CID 15941350
propane;2-prop-2-enyl-3,4-dihydroisoquinolin-1-one
CID 91165098
7-(hydroxymethyl)-2-prop-2-enyl-3,4-dihydroisoquinolin-1-one
CID 129283520
7-prop-2-enyl-5,6-dihydro-1,7-naphthyridin-8-one
CID 146344020
2-piperidin-1-yl-1H-pyrrolo[3,4-c]pyridin-3-one
CID 101456520
8-methoxy-2-prop-2-enyl-4,5-dihydro-3H-2-benzazepin-1-one
CID 22904998
3-bromoprop-1-ene;5,6-dihydrocyclopenta[c]pyridin-7-one;6-prop-2-enyl-5,6-dihydrocyclopenta[c]pyridin-7-one
CID 159647665
7-bromo-1-prop-2-enyl-2,3-dihydroquinolin-4-one
CID 68858984
propan-2-yl 2-[(1-oxo-3,4-dihydro-2,7-naphthyridin-2-yl)methyl]-1-benzofuran-7-carboxylate
CID 164866498
2-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyrrolo[3,4-c]pyridin-3-one
CID 101456517
2-[7-(hydroxymethyl)-1-oxo-3,4-dihydroisoquinolin-2-yl]acetaldehyde
CID 129306058
ethyl 3,4-dihydro-1H-2,7-naphthyridine-2-carboxylate
CID 23394084

Frequently Asked Questions

What is the IUPAC name of 2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one?
The IUPAC name of 2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one (CID 166583854) is 2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one.
What is the SMILES notation for 2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one?
The canonical SMILES for 2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one is C=CCN1CCc2ccncc2C1=O.
What is the InChIKey of 2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one?
The InChIKey is IWTDAJSJUUDQBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c1-2-6-13-7-4-9-3-5-12-8-10(9)11(13)14/h2-3,5,8H,1,4,6-7H2.
What are the key properties of 2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one?
2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one has a molecular weight of 188.23 g/mol, XLogP of 1.27, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enyl-3,4-dihydro-2,7-naphthyridin-1-one is sourced from PubChem (CID 166583854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).