2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol

C13H18ClNO — CID 60713491

IUPAC2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol
SMILESCC(NC1CCCC1O)c1cccc(Cl)c1
InChIInChI=1S/C13H18ClNO/c1-9(10-4-2-5-11(14)8-10)15-12-6-3-7-13(12)16/h2,4-5,8-9,12-13,15-16H,3,6-7H2,1H3
InChIKeyVMXVLPIVVYBNPF-UHFFFAOYSA-N
MW239.75 g/mol
LogP2.90
Rot. Bonds3

About 2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol

2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol (PubChem CID 60713491) has the molecular formula C13H18ClNO and a molecular weight of 239.75 g/mol. Its IUPAC name is 2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol
PubChem CID60713491
Molecular FormulaC13H18ClNO
Molecular Weight239.75 g/mol
Exact Mass239.11
IUPAC Name2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol
SMILESCC(NC1CCCC1O)c1cccc(Cl)c1
InChIInChI=1S/C13H18ClNO/c1-9(10-4-2-5-11(14)8-10)15-12-6-3-7-13(12)16/h2,4-5,8-9,12-13,15-16H,3,6-7H2,1H3
InChIKeyVMXVLPIVVYBNPF-UHFFFAOYSA-N
XLogP2.90
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.75
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol 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

trans-(1S,2S)-2-[[(1S)-1-(3-chlorophenyl)ethyl]amino]cyclohexan-1-ol
CID 93419082
trans-(1S,2S)-2-[1-(3-chlorophenyl)ethylamino]cyclohexan-1-ol
CID 104956148
N-[1-(3-chlorophenyl)ethyl]-2-methylcyclopentan-1-amine
CID 63277317
N-[(1S)-1-(3-chlorophenyl)ethyl]-2,3-dimethylcyclohexan-1-amine
CID 81366645
trans-(1R,2R)-2-[1-(3-fluorophenyl)ethylamino]cyclopentan-1-ol
CID 102733281
2-[1-(3-chlorophenyl)propylamino]cyclohexan-1-ol
CID 62365100
trans-(1R,2R)-2-[[(1S)-1-phenylethyl]amino]cyclopentan-1-ol
CID 10035860
trans-(1R,2R)-2-[[(1R)-1-phenylethyl]amino]cyclopentan-1-ol
CID 10171980
N-[(1S)-1-(3-chlorophenyl)ethyl]-2-methylsulfonylcyclopentan-1-amine
CID 81365892
2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]cyclohexan-1-ol
CID 81352447
2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]cycloheptan-1-ol
CID 81352634
N-[1-(3-chlorophenyl)ethyl]tricyclo[5.2.1.02,6]decan-8-amine
CID 43392322

Frequently Asked Questions

What is the IUPAC name of 2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol?
The IUPAC name of 2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol (CID 60713491) is 2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol.
What is the SMILES notation for 2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol?
The canonical SMILES for 2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol is CC(NC1CCCC1O)c1cccc(Cl)c1.
What is the InChIKey of 2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol?
The InChIKey is VMXVLPIVVYBNPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClNO/c1-9(10-4-2-5-11(14)8-10)15-12-6-3-7-13(12)16/h2,4-5,8-9,12-13,15-16H,3,6-7H2,1H3.
What are the key properties of 2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol?
2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol has a molecular weight of 239.75 g/mol, XLogP of 2.90, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(3-chlorophenyl)ethylamino]cyclopentan-1-ol is sourced from PubChem (CID 60713491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).