2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one

C15H18ClNO — CID 175247770

IUPAC2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one
SMILESO=C1CCCCC1(NC1CC1)c1ccccc1Cl
InChIInChI=1S/C15H18ClNO/c16-13-6-2-1-5-12(13)15(17-11-8-9-11)10-4-3-7-14(15)18/h1-2,5-6,11,17H,3-4,7-10H2
InChIKeyGWFLZLQWZVVVMA-UHFFFAOYSA-N
MW263.77 g/mol
LogP3.43
Rot. Bonds3

About 2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one

2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one (PubChem CID 175247770) has the molecular formula C15H18ClNO and a molecular weight of 263.77 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one.

Molecular Properties

Compound Name2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one
PubChem CID175247770
Molecular FormulaC15H18ClNO
Molecular Weight263.77 g/mol
Exact Mass263.11
IUPAC Name2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one
SMILESO=C1CCCCC1(NC1CC1)c1ccccc1Cl
InChIInChI=1S/C15H18ClNO/c16-13-6-2-1-5-12(13)15(17-11-8-9-11)10-4-3-7-14(15)18/h1-2,5-6,11,17H,3-4,7-10H2
InChIKeyGWFLZLQWZVVVMA-UHFFFAOYSA-N
XLogP3.43
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.77
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one 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

N-[1-(2-chlorophenyl)-2-oxocyclohexyl]acetamide
CID 91753398
N-[1-(2-chlorophenyl)-2-oxocyclohexyl]methanesulfonamide
CID 126521615
2-(2-chlorophenyl)-2-(trideuteriomethylamino)cyclohexan-1-one;hydrochloride
CID 117065469
methyl N-[(1S)-1-(2-chlorophenyl)-2-oxocyclohexyl]carbamate
CID 153325940
(2R)-2-(2-chlorophenyl)-2-hydroxycyclohexan-1-one
CID 76967267
2-amino-2-(2-chlorophenyl)cyclohexan-1-one;hydrochloride
CID 25195026
[[1-(2-chlorophenyl)-2-oxocyclohexyl]amino] octanoate
CID 174964875
(2S)-2-(2-chlorophenyl)-2-(cyclopropylmethylamino)-6,6-dideuteriocyclohexan-1-one
CID 175247775
(2R)-2-(2-chlorophenyl)-6,6-dideuterio-2-(methylamino)cyclohexan-1-one
CID 140925792
N-[[1-(2-chlorophenyl)cycloheptyl]methyl]cyclopropanamine
CID 63516646
(2R)-2-(2-chlorophenyl)-6-methyl-2-(methylamino)cyclohexan-1-one
CID 176774253
2-(2-chlorophenyl)-2-[hydroxy(methyl)amino]cyclohexan-1-one
CID 135034218

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one?
The IUPAC name of 2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one (CID 175247770) is 2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one.
What is the SMILES notation for 2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one?
The canonical SMILES for 2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one is O=C1CCCCC1(NC1CC1)c1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one?
The InChIKey is GWFLZLQWZVVVMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClNO/c16-13-6-2-1-5-12(13)15(17-11-8-9-11)10-4-3-7-14(15)18/h1-2,5-6,11,17H,3-4,7-10H2.
What are the key properties of 2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one?
2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one has a molecular weight of 263.77 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-2-(cyclopropylamino)cyclohexan-1-one is sourced from PubChem (CID 175247770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).