2-(3-chlorophenyl)-1-cyclopentylethanamine

C13H18ClN — CID 60818439

IUPAC2-(3-chlorophenyl)-1-cyclopentylethanamine
SMILESNC(Cc1cccc(Cl)c1)C1CCCC1
InChIInChI=1S/C13H18ClN/c14-12-7-3-4-10(8-12)9-13(15)11-5-1-2-6-11/h3-4,7-8,11,13H,1-2,5-6,9,15H2
InChIKeyHNVQPIVAEVYTTP-UHFFFAOYSA-N
MW223.75 g/mol
LogP3.40
Rot. Bonds3

About 2-(3-chlorophenyl)-1-cyclopentylethanamine

2-(3-chlorophenyl)-1-cyclopentylethanamine (PubChem CID 60818439) has the molecular formula C13H18ClN and a molecular weight of 223.75 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-1-cyclopentylethanamine.

Molecular Properties

Compound Name2-(3-chlorophenyl)-1-cyclopentylethanamine
PubChem CID60818439
Molecular FormulaC13H18ClN
Molecular Weight223.75 g/mol
Exact Mass223.11
IUPAC Name2-(3-chlorophenyl)-1-cyclopentylethanamine
SMILESNC(Cc1cccc(Cl)c1)C1CCCC1
InChIInChI=1S/C13H18ClN/c14-12-7-3-4-10(8-12)9-13(15)11-5-1-2-6-11/h3-4,7-8,11,13H,1-2,5-6,9,15H2
InChIKeyHNVQPIVAEVYTTP-UHFFFAOYSA-N
XLogP3.40
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.75
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-chlorophenyl)-1-cycloheptylethanol
CID 63518276
1-cyclopentyl-2-phenylethanamine
CID 50988646
2-(3-chlorophenyl)-1-(2-methylcyclopentyl)ethanamine
CID 107179608
2-(3-chlorophenyl)-1-(3-ethylcyclopentyl)ethanamine
CID 65411591
3-[1-amino-2-(3-chlorophenyl)ethyl]piperidine-1-carboxylic acid
CID 141133176
2-(3-chlorophenyl)-1-cycloheptyl-N-methylethanamine
CID 63528651
[2-(3-chlorophenyl)-1-cyclobutylethyl]hydrazine
CID 105195049
1-chloro-3-(2-methylpropyl)benzene;propan-2-ylcyclobutane
CID 163536568
2-[(3-chlorophenyl)methyl]-3-cyclopentylpropan-1-amine
CID 63497587
1-(2-bromo-3-cyclopentylpropyl)-3-chlorobenzene
CID 63530757
1-chloro-3-(2-chloro-2-cyclopropylethyl)benzene
CID 63016501
(1S)-1-cyclobutyl-2-phenylethanamine;phosphane
CID 143108875

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-1-cyclopentylethanamine?
The IUPAC name of 2-(3-chlorophenyl)-1-cyclopentylethanamine (CID 60818439) is 2-(3-chlorophenyl)-1-cyclopentylethanamine.
What is the SMILES notation for 2-(3-chlorophenyl)-1-cyclopentylethanamine?
The canonical SMILES for 2-(3-chlorophenyl)-1-cyclopentylethanamine is NC(Cc1cccc(Cl)c1)C1CCCC1.
What is the InChIKey of 2-(3-chlorophenyl)-1-cyclopentylethanamine?
The InChIKey is HNVQPIVAEVYTTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN/c14-12-7-3-4-10(8-12)9-13(15)11-5-1-2-6-11/h3-4,7-8,11,13H,1-2,5-6,9,15H2.
What are the key properties of 2-(3-chlorophenyl)-1-cyclopentylethanamine?
2-(3-chlorophenyl)-1-cyclopentylethanamine has a molecular weight of 223.75 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-1-cyclopentylethanamine is sourced from PubChem (CID 60818439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).