N-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine

C14H19Cl2N — CID 55193924

IUPACN-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine
SMILESCC(NC1CCCC1C)c1cc(Cl)ccc1Cl
InChIInChI=1S/C14H19Cl2N/c1-9-4-3-5-14(9)17-10(2)12-8-11(15)6-7-13(12)16/h6-10,14,17H,3-5H2,1-2H3
InChIKeyWDJPGCDNRSPHRX-UHFFFAOYSA-N
MW272.22 g/mol
LogP4.83
Rot. Bonds3

About N-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine

N-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine (PubChem CID 55193924) has the molecular formula C14H19Cl2N and a molecular weight of 272.22 g/mol. Its IUPAC name is N-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine
PubChem CID55193924
Molecular FormulaC14H19Cl2N
Molecular Weight272.22 g/mol
Exact Mass271.09
IUPAC NameN-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine
SMILESCC(NC1CCCC1C)c1cc(Cl)ccc1Cl
InChIInChI=1S/C14H19Cl2N/c1-9-4-3-5-14(9)17-10(2)12-8-11(15)6-7-13(12)16/h6-10,14,17H,3-5H2,1-2H3
InChIKeyWDJPGCDNRSPHRX-UHFFFAOYSA-N
XLogP4.83
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.22
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1S)-1-(4-chlorophenyl)ethyl]-2-methylcyclopentan-1-amine
CID 81353352
N-[1-(4-chlorophenyl)ethyl]-2-methylcyclopentan-1-amine
CID 63277047
2-[1-(2,5-dichlorophenyl)ethylamino]cyclopentane-1-carbonitrile
CID 62962007
N-[1-(2,5-dichlorophenyl)ethyl]-1,3-dimethylpiperidin-4-amine
CID 115714676
N-[1-(2,5-dichlorophenyl)ethyl]-3-methylcyclohexan-1-amine
CID 43317718
N-[1-(3-chlorophenyl)ethyl]-2-methylcyclopentan-1-amine
CID 63277317
N-[1-(2,4-dichlorophenyl)propyl]-2-methylcyclopentan-1-amine
CID 63463585
N-[1-(2,4-dichlorophenyl)ethyl]-2-methylcyclopropan-1-amine
CID 62397096
N-[1-(2,6-dichloro-3-fluorophenyl)ethyl]-2,3-dimethylcyclohexan-1-amine
CID 43545096
N-[1-(2-methoxyphenyl)ethyl]-2-methylcyclopentan-1-amine
CID 63278312
(1R)-1-cycloheptyl-N-[1-(2,5-dichlorophenyl)ethyl]ethanamine
CID 81392727
N-[(1S)-1-(3-chlorophenyl)ethyl]-2,3-dimethylcyclohexan-1-amine
CID 81366645

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine?
The IUPAC name of N-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine (CID 55193924) is N-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine.
What is the SMILES notation for N-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine?
The canonical SMILES for N-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine is CC(NC1CCCC1C)c1cc(Cl)ccc1Cl.
What is the InChIKey of N-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine?
The InChIKey is WDJPGCDNRSPHRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19Cl2N/c1-9-4-3-5-14(9)17-10(2)12-8-11(15)6-7-13(12)16/h6-10,14,17H,3-5H2,1-2H3.
What are the key properties of N-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine?
N-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine has a molecular weight of 272.22 g/mol, XLogP of 4.83, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,5-dichlorophenyl)ethyl]-2-methylcyclopentan-1-amine is sourced from PubChem (CID 55193924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).