2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine

C14H19Cl2N — CID 65318436

IUPAC2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine
SMILESCCNC1CCCC1Cc1cc(Cl)ccc1Cl
InChIInChI=1S/C14H19Cl2N/c1-2-17-14-5-3-4-10(14)8-11-9-12(15)6-7-13(11)16/h6-7,9-10,14,17H,2-5,8H2,1H3
InChIKeyGUOARROFAOBKCS-UHFFFAOYSA-N
MW272.22 g/mol
LogP4.31
Rot. Bonds4

About 2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine

2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine (PubChem CID 65318436) has the molecular formula C14H19Cl2N and a molecular weight of 272.22 g/mol. Its IUPAC name is 2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine.

Molecular Properties

Compound Name2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine
PubChem CID65318436
Molecular FormulaC14H19Cl2N
Molecular Weight272.22 g/mol
Exact Mass271.09
IUPAC Name2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine
SMILESCCNC1CCCC1Cc1cc(Cl)ccc1Cl
InChIInChI=1S/C14H19Cl2N/c1-2-17-14-5-3-4-10(14)8-11-9-12(15)6-7-13(11)16/h6-7,9-10,14,17H,2-5,8H2,1H3
InChIKeyGUOARROFAOBKCS-UHFFFAOYSA-N
XLogP4.31
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.22
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(2,4-dichlorophenyl)methyl]-N-propylcyclohexan-1-amine
CID 63399956
2-[(5-chloro-2-fluorophenyl)methyl]-N-methylcyclopentan-1-amine
CID 103047204
N-ethyl-2-[(2-methylphenyl)methyl]cyclopentan-1-amine
CID 61381447
2-(2,5-dichlorophenyl)sulfinyl-N-ethylcyclopentan-1-amine
CID 64657347
N-[(5-chloro-2-fluorophenyl)methyl]-2-(chloromethyl)cyclopentan-1-amine
CID 106365036
3-[(2-chloro-5-fluorophenyl)methyl]-N-ethyl-2-methylcyclopentan-1-amine
CID 102620493
2-[(3,4-dimethylphenyl)methyl]-N-ethylcyclopentan-1-amine
CID 54978274
N-ethyl-2-[(5-fluoro-2-methylphenyl)methyl]cyclohexan-1-amine
CID 105372322
N-ethyl-2-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-amine
CID 55085442
2-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]-N-ethylcyclopentan-1-amine
CID 103291093
2-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-ethylcyclopentan-1-amine
CID 62610200
3-[(2,5-dichlorophenyl)methyl]-N-methyloxan-4-amine
CID 71648098

Frequently Asked Questions

What is the IUPAC name of 2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine?
The IUPAC name of 2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine (CID 65318436) is 2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine.
What is the SMILES notation for 2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine?
The canonical SMILES for 2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine is CCNC1CCCC1Cc1cc(Cl)ccc1Cl.
What is the InChIKey of 2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine?
The InChIKey is GUOARROFAOBKCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19Cl2N/c1-2-17-14-5-3-4-10(14)8-11-9-12(15)6-7-13(11)16/h6-7,9-10,14,17H,2-5,8H2,1H3.
What are the key properties of 2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine?
2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine has a molecular weight of 272.22 g/mol, XLogP of 4.31, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,5-dichlorophenyl)methyl]-N-ethylcyclopentan-1-amine is sourced from PubChem (CID 65318436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).