3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone

C15H14N2O — CID 743438

IUPAC3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone
SMILESO=C(c1cccnc1)N1CCCc2ccccc21
InChIInChI=1S/C15H14N2O/c18-15(13-6-3-9-16-11-13)17-10-4-7-12-5-1-2-8-14(12)17/h1-3,5-6,8-9,11H,4,7,10H2
InChIKeyFZSRJRDHOSQBIG-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.67
Rot. Bonds1

About 3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone

3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone (PubChem CID 743438) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone.

Molecular Properties

Compound Name3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone
PubChem CID743438
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone
SMILESO=C(c1cccnc1)N1CCCc2ccccc21
InChIInChI=1S/C15H14N2O/c18-15(13-6-3-9-16-11-13)17-10-4-7-12-5-1-2-8-14(12)17/h1-3,5-6,8-9,11H,4,7,10H2
InChIKeyFZSRJRDHOSQBIG-UHFFFAOYSA-N
XLogP2.67
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone?
The IUPAC name of 3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone (CID 743438) is 3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone.
What is the SMILES notation for 3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone?
The canonical SMILES for 3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone is O=C(c1cccnc1)N1CCCc2ccccc21.
What is the InChIKey of 3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone?
The InChIKey is FZSRJRDHOSQBIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c18-15(13-6-3-9-16-11-13)17-10-4-7-12-5-1-2-8-14(12)17/h1-3,5-6,8-9,11H,4,7,10H2.
What are the key properties of 3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone?
3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone has a molecular weight of 238.29 g/mol, XLogP of 2.67, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-quinolin-1-yl(pyridin-3-yl)methanone is sourced from PubChem (CID 743438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).