2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine

C15H21Cl2N — CID 107189012

IUPAC2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine
SMILESCC1(C)CCCC1C(N)Cc1cc(Cl)ccc1Cl
InChIInChI=1S/C15H21Cl2N/c1-15(2)7-3-4-12(15)14(18)9-10-8-11(16)5-6-13(10)17/h5-6,8,12,14H,3-4,7,9,18H2,1-2H3
InChIKeyIIRWCUHMYMXARB-UHFFFAOYSA-N
MW286.25 g/mol
LogP4.69
Rot. Bonds3

About 2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine

2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine (PubChem CID 107189012) has the molecular formula C15H21Cl2N and a molecular weight of 286.25 g/mol. Its IUPAC name is 2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine.

Molecular Properties

Compound Name2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine
PubChem CID107189012
Molecular FormulaC15H21Cl2N
Molecular Weight286.25 g/mol
Exact Mass285.11
IUPAC Name2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine
SMILESCC1(C)CCCC1C(N)Cc1cc(Cl)ccc1Cl
InChIInChI=1S/C15H21Cl2N/c1-15(2)7-3-4-12(15)14(18)9-10-8-11(16)5-6-13(10)17/h5-6,8,12,14H,3-4,7,9,18H2,1-2H3
InChIKeyIIRWCUHMYMXARB-UHFFFAOYSA-N
XLogP4.69
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.25
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethyl]propan-1-amine
CID 107189010
2-(3-chloro-2-fluorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine
CID 107191661
(2,5-dichlorophenyl)-(2,2-dimethylcyclopentyl)methanol
CID 107181647
2-(2,3-difluorophenyl)-1-(2,2-dimethylcyclohexyl)ethanamine
CID 107179648
2-(2,5-dichlorophenyl)-1-(3-methylcyclohexyl)ethanamine
CID 65321480
[2-(5-chloro-2-methoxyphenyl)-1-(2,2-dimethylcyclopentyl)ethyl]hydrazine
CID 107193657
2-(5-bromo-2-methoxyphenyl)-1-(2,2-dimethylcyclopentyl)ethanamine
CID 107188007
2-(5-chloro-2-methoxyphenyl)-1-(2,2-dimethylcyclopentyl)-N-methylethanamine
CID 107188374
N-[(2,5-dichlorophenyl)-(2,2-dimethylcyclopentyl)methyl]ethanamine
CID 107177443
2-(2-bromo-4-fluorophenyl)-1-(2,2-dimethylcyclohexyl)ethanamine
CID 107188309
1-(2,2-dimethylcyclopentyl)-2-thiophen-2-ylethanamine
CID 107179421
(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methanamine
CID 107178190

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine?
The IUPAC name of 2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine (CID 107189012) is 2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine.
What is the SMILES notation for 2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine?
The canonical SMILES for 2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine is CC1(C)CCCC1C(N)Cc1cc(Cl)ccc1Cl.
What is the InChIKey of 2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine?
The InChIKey is IIRWCUHMYMXARB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21Cl2N/c1-15(2)7-3-4-12(15)14(18)9-10-8-11(16)5-6-13(10)17/h5-6,8,12,14H,3-4,7,9,18H2,1-2H3.
What are the key properties of 2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine?
2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine has a molecular weight of 286.25 g/mol, XLogP of 4.69, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenyl)-1-(2,2-dimethylcyclopentyl)ethanamine is sourced from PubChem (CID 107189012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).