1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine

C15H22ClN — CID 55191954

IUPAC1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine
SMILESCC(NCCC1CCCC1)c1ccccc1Cl
InChIInChI=1S/C15H22ClN/c1-12(14-8-4-5-9-15(14)16)17-11-10-13-6-2-3-7-13/h4-5,8-9,12-13,17H,2-3,6-7,10-11H2,1H3
InChIKeyPWSVHPQRMDECFF-UHFFFAOYSA-N
MW251.80 g/mol
LogP4.57
Rot. Bonds5

About 1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine

1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine (PubChem CID 55191954) has the molecular formula C15H22ClN and a molecular weight of 251.80 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine.

Molecular Properties

Compound Name1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine
PubChem CID55191954
Molecular FormulaC15H22ClN
Molecular Weight251.80 g/mol
Exact Mass251.14
IUPAC Name1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine
SMILESCC(NCCC1CCCC1)c1ccccc1Cl
InChIInChI=1S/C15H22ClN/c1-12(14-8-4-5-9-15(14)16)17-11-10-13-6-2-3-7-13/h4-5,8-9,12-13,17H,2-3,6-7,10-11H2,1H3
InChIKeyPWSVHPQRMDECFF-UHFFFAOYSA-N
XLogP4.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.80
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S)-1-(2-chlorophenyl)-N-(2-cyclopropylethyl)ethanamine
CID 81378406
(1R)-1-(2-chlorophenyl)-N-(cycloheptylmethyl)ethanamine
CID 81377732
(1S)-1-(2-chlorophenyl)-N-(cycloheptylmethyl)ethanamine
CID 81377152
2-[1-(2-cyclohexylethylamino)ethyl]phenol
CID 54931684
(1R)-1-(2-chlorophenyl)-N-(cyclobutylmethyl)ethanamine
CID 81377860
(1R)-1-(2-bromophenyl)-N-(2-cyclohexylethyl)ethanamine
CID 81378704
N-(2-cyclohexylethyl)-1-(2-methoxyphenyl)ethanamine
CID 54931731
N-(2-cyclopentylethyl)-1-(2-ethoxyphenyl)ethanamine
CID 54932052
N-(2-cyclobutylethyl)-1-phenylethanamine
CID 115688569
N-(2-cyclohexylethyl)-1-(2,4-dichloro-5-fluorophenyl)ethanamine
CID 63450527
(1S)-1-(2-chlorophenyl)-N-[[(3R)-oxan-3-yl]methyl]ethanamine
CID 93447506
N-[1-(2-chlorophenyl)ethyl]-3-(2-methylpiperidin-1-yl)propan-1-amine
CID 43080661

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine?
The IUPAC name of 1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine (CID 55191954) is 1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine.
What is the SMILES notation for 1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine?
The canonical SMILES for 1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine is CC(NCCC1CCCC1)c1ccccc1Cl.
What is the InChIKey of 1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine?
The InChIKey is PWSVHPQRMDECFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClN/c1-12(14-8-4-5-9-15(14)16)17-11-10-13-6-2-3-7-13/h4-5,8-9,12-13,17H,2-3,6-7,10-11H2,1H3.
What are the key properties of 1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine?
1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine has a molecular weight of 251.80 g/mol, XLogP of 4.57, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-N-(2-cyclopentylethyl)ethanamine is sourced from PubChem (CID 55191954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).