4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one

C16H17NO2 — CID 6618949

IUPAC4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one
SMILESCOc1ccccc1-c1cc(=O)[nH]c2c1CCCC2
InChIInChI=1S/C16H17NO2/c1-19-15-9-5-3-7-12(15)13-10-16(18)17-14-8-4-2-6-11(13)14/h3,5,7,9-10H,2,4,6,8H2,1H3,(H,17,18)
InChIKeySTUQCYZJNGKPCJ-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.93
Rot. Bonds2

About 4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one

4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one (PubChem CID 6618949) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is 4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one.

Molecular Properties

Compound Name4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one
PubChem CID6618949
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one
SMILESCOc1ccccc1-c1cc(=O)[nH]c2c1CCCC2
InChIInChI=1S/C16H17NO2/c1-19-15-9-5-3-7-12(15)13-10-16(18)17-14-8-4-2-6-11(13)14/h3,5,7,9-10H,2,4,6,8H2,1H3,(H,17,18)
InChIKeySTUQCYZJNGKPCJ-UHFFFAOYSA-N
XLogP2.93
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-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 4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one?
The IUPAC name of 4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one (CID 6618949) is 4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one.
What is the SMILES notation for 4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one?
The canonical SMILES for 4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one is COc1ccccc1-c1cc(=O)[nH]c2c1CCCC2.
What is the InChIKey of 4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one?
The InChIKey is STUQCYZJNGKPCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c1-19-15-9-5-3-7-12(15)13-10-16(18)17-14-8-4-2-6-11(13)14/h3,5,7,9-10H,2,4,6,8H2,1H3,(H,17,18).
What are the key properties of 4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one?
4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one has a molecular weight of 255.32 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenyl)-5,6,7,8-tetrahydro-1H-quinolin-2-one is sourced from PubChem (CID 6618949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).