(2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone

C13H16ClNO — CID 116607206

IUPAC(2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone
SMILESCC1(C(=O)c2ccc(Cl)cc2)CCCC1N
InChIInChI=1S/C13H16ClNO/c1-13(8-2-3-11(13)15)12(16)9-4-6-10(14)7-5-9/h4-7,11H,2-3,8,15H2,1H3
InChIKeyHTMKJWNBZDBLJD-UHFFFAOYSA-N
MW237.73 g/mol
LogP3.04
Rot. Bonds2

About (2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone

(2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone (PubChem CID 116607206) has the molecular formula C13H16ClNO and a molecular weight of 237.73 g/mol. Its IUPAC name is (2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone.

Molecular Properties

Compound Name(2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone
PubChem CID116607206
Molecular FormulaC13H16ClNO
Molecular Weight237.73 g/mol
Exact Mass237.09
IUPAC Name(2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone
SMILESCC1(C(=O)c2ccc(Cl)cc2)CCCC1N
InChIInChI=1S/C13H16ClNO/c1-13(8-2-3-11(13)15)12(16)9-4-6-10(14)7-5-9/h4-7,11H,2-3,8,15H2,1H3
InChIKeyHTMKJWNBZDBLJD-UHFFFAOYSA-N
XLogP3.04
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.73
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2-amino-1-methylcyclopentyl)-(4-chlorophenyl)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

(2-amino-1-methylcyclopentyl)-(4-methoxyphenyl)methanone
CID 116607273
(2-amino-1-methylcyclopentyl)-(3-chloro-4-methylphenyl)methanone
CID 107561390
(2-amino-1-methylcyclopentyl)-(furan-3-yl)methanone
CID 116607397
(2-amino-1-methylcyclopentyl)-(3-propylphenyl)methanone
CID 116607279
2-[(2-amino-1-methylcyclopentanecarbonyl)amino]-4-chlorobenzoic acid
CID 82768134
(1R)-2-amino-1-methylcyclopentane-1-carboxylic acid
CID 129318014
trans-(1S,2R)-2-amino-1-methylcyclopentane-1-carboxylic acid
CID 55284582
(2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone
CID 116607144
1-(2-amino-1-methylcyclopentyl)-2-(2,6-dichlorophenyl)ethanone
CID 116607168
(4-chlorophenyl)-[1-(dimethylamino)cyclohexyl]methanone
CID 79066108
(2-amino-1-methylcyclopentyl)-(5-ethoxy-3-pyridinyl)methanone
CID 116607379
(4-chlorophenyl)-(1-hydroxycyclopentyl)methanone
CID 20523462

Frequently Asked Questions

What is the IUPAC name of (2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone?
The IUPAC name of (2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone (CID 116607206) is (2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone.
What is the SMILES notation for (2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone?
The canonical SMILES for (2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone is CC1(C(=O)c2ccc(Cl)cc2)CCCC1N.
What is the InChIKey of (2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone?
The InChIKey is HTMKJWNBZDBLJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClNO/c1-13(8-2-3-11(13)15)12(16)9-4-6-10(14)7-5-9/h4-7,11H,2-3,8,15H2,1H3.
What are the key properties of (2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone?
(2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone has a molecular weight of 237.73 g/mol, XLogP of 3.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-1-methylcyclopentyl)-(4-chlorophenyl)methanone is sourced from PubChem (CID 116607206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).