N-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine

C14H20ClN — CID 43694776

IUPACN-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine
SMILESCC(Cc1cccc(Cl)c1)NC1CCCC1
InChIInChI=1S/C14H20ClN/c1-11(16-14-7-2-3-8-14)9-12-5-4-6-13(15)10-12/h4-6,10-11,14,16H,2-3,7-9H2,1H3
InChIKeyLRLQPWMUDZWAEF-UHFFFAOYSA-N
MW237.77 g/mol
LogP3.80
Rot. Bonds4

About N-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine

N-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine (PubChem CID 43694776) has the molecular formula C14H20ClN and a molecular weight of 237.77 g/mol. Its IUPAC name is N-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine.

Molecular Properties

Compound NameN-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine
PubChem CID43694776
Molecular FormulaC14H20ClN
Molecular Weight237.77 g/mol
Exact Mass237.13
IUPAC NameN-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine
SMILESCC(Cc1cccc(Cl)c1)NC1CCCC1
InChIInChI=1S/C14H20ClN/c1-11(16-14-7-2-3-8-14)9-12-5-4-6-13(15)10-12/h4-6,10-11,14,16H,2-3,7-9H2,1H3
InChIKeyLRLQPWMUDZWAEF-UHFFFAOYSA-N
XLogP3.80
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.77
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(3-chlorophenyl)propan-2-yl]oxepan-4-amine
CID 65081836
4-N-[1-(3-chlorophenyl)propan-2-yl]cyclohexane-1,4-diamine
CID 79724820
1-N-[1-(3-chlorophenyl)propan-2-yl]cyclohexane-1,3-diamine
CID 79459034
N-[1-(3-chlorophenyl)propan-2-yl]-1-oxothian-4-amine
CID 54981472
N-[1-(3-chlorophenyl)propan-2-yl]thiolan-3-amine
CID 43694783
N-[1-(3-chlorophenyl)propan-2-yl]-3,3-dimethylcyclopentan-1-amine
CID 80705084
N-[1-(3-bromophenyl)propan-2-yl]cyclopentanamine
CID 82262667
2-tert-butyl-N-[1-(3-chlorophenyl)propan-2-yl]cyclohexan-1-amine
CID 43694786
N-[1-(4-chlorophenyl)propan-2-yl]cycloheptanamine
CID 43677619
N-[1-(3-chlorophenyl)propan-2-yl]-2,2-dimethylcyclopentan-1-amine
CID 79860721
N-[1-(3-chlorophenyl)propan-2-yl]-1-cyclopropyl-5-methylpyrrolidin-3-amine
CID 115713569
2-(3-chlorophenyl)-1-cycloheptyl-N-methylethanamine
CID 63528651

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine?
The IUPAC name of N-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine (CID 43694776) is N-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine.
What is the SMILES notation for N-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine?
The canonical SMILES for N-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine is CC(Cc1cccc(Cl)c1)NC1CCCC1.
What is the InChIKey of N-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine?
The InChIKey is LRLQPWMUDZWAEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN/c1-11(16-14-7-2-3-8-14)9-12-5-4-6-13(15)10-12/h4-6,10-11,14,16H,2-3,7-9H2,1H3.
What are the key properties of N-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine?
N-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine has a molecular weight of 237.77 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-chlorophenyl)propan-2-yl]cyclopentanamine is sourced from PubChem (CID 43694776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).