2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one

C16H15NO2 — CID 10444977

IUPAC2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one
SMILESO=C1CCCc2nc(OCc3ccccc3)ccc21
InChIInChI=1S/C16H15NO2/c18-15-8-4-7-14-13(15)9-10-16(17-14)19-11-12-5-2-1-3-6-12/h1-3,5-6,9-10H,4,7-8,11H2
InChIKeyVGMBEUFDLPGOMH-UHFFFAOYSA-N
MW253.30 g/mol
LogP3.18
Rot. Bonds3

About 2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one

2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one (PubChem CID 10444977) has the molecular formula C16H15NO2 and a molecular weight of 253.30 g/mol. Its IUPAC name is 2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one.

Molecular Properties

Compound Name2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one
PubChem CID10444977
Molecular FormulaC16H15NO2
Molecular Weight253.30 g/mol
Exact Mass253.11
IUPAC Name2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one
SMILESO=C1CCCc2nc(OCc3ccccc3)ccc21
InChIInChI=1S/C16H15NO2/c18-15-8-4-7-14-13(15)9-10-16(17-14)19-11-12-5-2-1-3-6-12/h1-3,5-6,9-10H,4,7-8,11H2
InChIKeyVGMBEUFDLPGOMH-UHFFFAOYSA-N
XLogP3.18
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one 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 2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one?
The IUPAC name of 2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one (CID 10444977) is 2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one.
What is the SMILES notation for 2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one?
The canonical SMILES for 2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one is O=C1CCCc2nc(OCc3ccccc3)ccc21.
What is the InChIKey of 2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one?
The InChIKey is VGMBEUFDLPGOMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO2/c18-15-8-4-7-14-13(15)9-10-16(17-14)19-11-12-5-2-1-3-6-12/h1-3,5-6,9-10H,4,7-8,11H2.
What are the key properties of 2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one?
2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one has a molecular weight of 253.30 g/mol, XLogP of 3.18, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylmethoxy-7,8-dihydro-6H-quinolin-5-one is sourced from PubChem (CID 10444977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).