N-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine

C14H18ClN — CID 115901876

IUPACN-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine
SMILESClc1cccc(C2(NC3CCCC3)CC2)c1
InChIInChI=1S/C14H18ClN/c15-12-5-3-4-11(10-12)14(8-9-14)16-13-6-1-2-7-13/h3-5,10,13,16H,1-2,6-9H2
InChIKeyARWOOWWUGQLHLT-UHFFFAOYSA-N
MW235.76 g/mol
LogP3.86
Rot. Bonds3

About N-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine

N-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine (PubChem CID 115901876) has the molecular formula C14H18ClN and a molecular weight of 235.76 g/mol. Its IUPAC name is N-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine.

Molecular Properties

Compound NameN-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine
PubChem CID115901876
Molecular FormulaC14H18ClN
Molecular Weight235.76 g/mol
Exact Mass235.11
IUPAC NameN-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine
SMILESClc1cccc(C2(NC3CCCC3)CC2)c1
InChIInChI=1S/C14H18ClN/c15-12-5-3-4-11(10-12)14(8-9-14)16-13-6-1-2-7-13/h3-5,10,13,16H,1-2,6-9H2
InChIKeyARWOOWWUGQLHLT-UHFFFAOYSA-N
XLogP3.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.76
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine?
The IUPAC name of N-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine (CID 115901876) is N-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine.
What is the SMILES notation for N-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine?
The canonical SMILES for N-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine is Clc1cccc(C2(NC3CCCC3)CC2)c1.
What is the InChIKey of N-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine?
The InChIKey is ARWOOWWUGQLHLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClN/c15-12-5-3-4-11(10-12)14(8-9-14)16-13-6-1-2-7-13/h3-5,10,13,16H,1-2,6-9H2.
What are the key properties of N-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine?
N-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine has a molecular weight of 235.76 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-chlorophenyl)cyclopropyl]cyclopentanamine is sourced from PubChem (CID 115901876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).