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

C17H17NO2 — CID 755245

IUPAC3,4-dihydro-2H-quinolin-1-yl-(3-methoxyphenyl)methanone
SMILESCOc1cccc(C(=O)N2CCCc3ccccc32)c1
InChIInChI=1S/C17H17NO2/c1-20-15-9-4-7-14(12-15)17(19)18-11-5-8-13-6-2-3-10-16(13)18/h2-4,6-7,9-10,12H,5,8,11H2,1H3
InChIKeyQWAFFOCOBWNZAI-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.29
Rot. Bonds2

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

3,4-dihydro-2H-quinolin-1-yl-(3-methoxyphenyl)methanone (PubChem CID 755245) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is 3,4-dihydro-2H-quinolin-1-yl-(3-methoxyphenyl)methanone.

Molecular Properties

Compound Name3,4-dihydro-2H-quinolin-1-yl-(3-methoxyphenyl)methanone
PubChem CID755245
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC Name3,4-dihydro-2H-quinolin-1-yl-(3-methoxyphenyl)methanone
SMILESCOc1cccc(C(=O)N2CCCc3ccccc32)c1
InChIInChI=1S/C17H17NO2/c1-20-15-9-4-7-14(12-15)17(19)18-11-5-8-13-6-2-3-10-16(13)18/h2-4,6-7,9-10,12H,5,8,11H2,1H3
InChIKeyQWAFFOCOBWNZAI-UHFFFAOYSA-N
XLogP3.29
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

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

Launch Full Analysis

Related Compounds

(7-amino-3,4-dihydro-2H-quinolin-1-yl)-(3-methoxyphenyl)methanone
CID 28707170
(3-methoxyphenyl)-[6-(trifluoromethyl)-3,4-dihydro-2H-quinolin-1-yl]methanone
CID 31840032
3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)benzamide
CID 109057134
(6-methoxy-3,4-dihydro-2H-quinolin-1-yl)-(3-methylphenyl)methanone
CID 17480877
3,4-dihydro-2H-quinolin-1-yl-(3-methylphenyl)methanone
CID 669077
3,4-dihydro-2H-quinolin-1-yl-(3-methoxy-4-methylphenyl)methanone
CID 51229053
2,3-dihydroindol-1-yl-(3,5-dimethoxyphenyl)methanone
CID 687165
(3-methoxyphenyl)-[9-[(4-methoxyphenyl)methyl]-2,9-diazabicyclo[9.4.0]pentadeca-1(15),11,13-trien-2-yl]methanone
CID 110065030
3-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methoxyphenyl)-N-methylbenzenesulfonamide
CID 26911133
2-(3,4-dihydro-2H-quinolin-1-yl)-1-(3-methoxyphenyl)ethanone
CID 43227216
1-(1-benzoyl-3,4-dihydro-2H-quinolin-7-yl)-3-(3-methoxyphenyl)urea
CID 30372497
3,4-dihydro-2H-quinolin-1-yl-(2,6-dimethoxyphenyl)methanone
CID 5061013

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-quinolin-1-yl-(3-methoxyphenyl)methanone?
The IUPAC name of 3,4-dihydro-2H-quinolin-1-yl-(3-methoxyphenyl)methanone (CID 755245) is 3,4-dihydro-2H-quinolin-1-yl-(3-methoxyphenyl)methanone.
What is the SMILES notation for 3,4-dihydro-2H-quinolin-1-yl-(3-methoxyphenyl)methanone?
The canonical SMILES for 3,4-dihydro-2H-quinolin-1-yl-(3-methoxyphenyl)methanone is COc1cccc(C(=O)N2CCCc3ccccc32)c1.
What is the InChIKey of 3,4-dihydro-2H-quinolin-1-yl-(3-methoxyphenyl)methanone?
The InChIKey is QWAFFOCOBWNZAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2/c1-20-15-9-4-7-14(12-15)17(19)18-11-5-8-13-6-2-3-10-16(13)18/h2-4,6-7,9-10,12H,5,8,11H2,1H3.
What are the key properties of 3,4-dihydro-2H-quinolin-1-yl-(3-methoxyphenyl)methanone?
3,4-dihydro-2H-quinolin-1-yl-(3-methoxyphenyl)methanone has a molecular weight of 267.33 g/mol, XLogP of 3.29, 2 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-(3-methoxyphenyl)methanone is sourced from PubChem (CID 755245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).