[1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone

C19H26ClNO2 — CID 134048238

IUPAC[1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone
SMILESCOC1CCN(C(=O)C2(c3cccc(Cl)c3)CCCCC2)CC1
InChIInChI=1S/C19H26ClNO2/c1-23-17-8-12-21(13-9-17)18(22)19(10-3-2-4-11-19)15-6-5-7-16(20)14-15/h5-7,14,17H,2-4,8-13H2,1H3
InChIKeyPHNQHPPJXYUBEE-UHFFFAOYSA-N
MW335.88 g/mol
LogP4.18
Rot. Bonds3

About [1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone

[1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone (PubChem CID 134048238) has the molecular formula C19H26ClNO2 and a molecular weight of 335.88 g/mol. Its IUPAC name is [1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone.

Molecular Properties

Compound Name[1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone
PubChem CID134048238
Molecular FormulaC19H26ClNO2
Molecular Weight335.88 g/mol
Exact Mass335.17
IUPAC Name[1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone
SMILESCOC1CCN(C(=O)C2(c3cccc(Cl)c3)CCCCC2)CC1
InChIInChI=1S/C19H26ClNO2/c1-23-17-8-12-21(13-9-17)18(22)19(10-3-2-4-11-19)15-6-5-7-16(20)14-15/h5-7,14,17H,2-4,8-13H2,1H3
InChIKeyPHNQHPPJXYUBEE-UHFFFAOYSA-N
XLogP4.18
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.88
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze [1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-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

Related Compounds

[1-(3-chlorophenyl)cyclobutyl]-(4-methylpiperidin-1-yl)methanone
CID 134018025
[1-(3-chlorophenyl)cyclohexyl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 111560944
[1-(3-chlorophenyl)cyclohexyl]-piperazin-1-ylmethanone
CID 119401673
[1-(3-chlorophenyl)cyclopropyl]-[(4R)-4-methylazepan-1-yl]methanone
CID 97023604
1-[1-(3-chlorophenyl)cyclohexanecarbonyl]-4-hydroxypiperidine-4-carboxylic acid
CID 119251972
[1-(3-chlorophenyl)cyclopentyl]-(4-propan-2-ylpiperazin-1-yl)methanone
CID 55687550
[1-(3-chlorophenyl)cyclopentyl]-(3,9-diazabicyclo[4.2.1]nonan-3-yl)methanone
CID 119638687
[3-(aminomethyl)pyrrolidin-1-yl]-[1-(3-chlorophenyl)cyclopentyl]methanone
CID 119486633
[4-(1-aminoethyl)piperidin-1-yl]-[1-(3-chlorophenyl)cyclopropyl]methanone
CID 119516866
6-[1-(3-chlorophenyl)cyclopentanecarbonyl]-6-azaspiro[2.5]octane-2-carboxylic acid
CID 119174947
[1-(4-bromophenyl)cyclobutyl]-(4-methoxypiperidin-1-yl)methanone
CID 55555458
2-[4-[1-(3-chlorophenyl)cyclohexanecarbonyl]piperazin-1-yl]-N-cyclopropylacetamide
CID 134047573

Frequently Asked Questions

What is the IUPAC name of [1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone?
The IUPAC name of [1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone (CID 134048238) is [1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone.
What is the SMILES notation for [1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone?
The canonical SMILES for [1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone is COC1CCN(C(=O)C2(c3cccc(Cl)c3)CCCCC2)CC1.
What is the InChIKey of [1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone?
The InChIKey is PHNQHPPJXYUBEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26ClNO2/c1-23-17-8-12-21(13-9-17)18(22)19(10-3-2-4-11-19)15-6-5-7-16(20)14-15/h5-7,14,17H,2-4,8-13H2,1H3.
What are the key properties of [1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone?
[1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone has a molecular weight of 335.88 g/mol, XLogP of 4.18, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chlorophenyl)cyclohexyl]-(4-methoxypiperidin-1-yl)methanone is sourced from PubChem (CID 134048238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).