N-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine

C15H23N — CID 81300917

IUPACN-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine
SMILESCc1cc(C)cc(C(C)NC2CCCC2)c1
InChIInChI=1S/C15H23N/c1-11-8-12(2)10-14(9-11)13(3)16-15-6-4-5-7-15/h8-10,13,15-16H,4-7H2,1-3H3
InChIKeyPORQHZGDSJQROK-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.90
Rot. Bonds3

About N-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine

N-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine (PubChem CID 81300917) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is N-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine.

Molecular Properties

Compound NameN-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine
PubChem CID81300917
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC NameN-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine
SMILESCc1cc(C)cc(C(C)NC2CCCC2)c1
InChIInChI=1S/C15H23N/c1-11-8-12(2)10-14(9-11)13(3)16-15-6-4-5-7-15/h8-10,13,15-16H,4-7H2,1-3H3
InChIKeyPORQHZGDSJQROK-UHFFFAOYSA-N
XLogP3.90
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(3,5-dimethylphenyl)ethyl]oxan-3-amine
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4-[1-(cyclopentylamino)ethyl]aniline
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N-[1-(3,5-dimethylphenyl)ethyl]thiolan-3-amine
CID 115718210
N-[1-[3-methyl-5-(trifluoromethyl)phenyl]ethyl]cyclopropanamine
CID 118313294
N-[1-(3,5-dimethylphenyl)ethyl]-1-methylsulfonylpiperidin-4-amine
CID 81296653
N-[1-(4-methylphenyl)ethyl]cyclopropanamine
CID 16771025
N-[1-(3,4-difluorophenyl)ethyl]cycloheptanamine
CID 43081886
N-[1-(3,4-dichlorophenyl)ethyl]cyclohexanamine
CID 43078885
N-(1-phenylethyl)cyclododecanamine
CID 60662638
N-[1-(4-tert-butylphenyl)ethyl]cycloheptanamine
CID 43095672
N-[1-(4-phenylphenyl)ethyl]cyclopentanamine
CID 43078880
N-(1-naphthalen-2-ylethyl)cyclohexanamine
CID 43080679

Frequently Asked Questions

What is the IUPAC name of N-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine?
The IUPAC name of N-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine (CID 81300917) is N-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine.
What is the SMILES notation for N-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine?
The canonical SMILES for N-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine is Cc1cc(C)cc(C(C)NC2CCCC2)c1.
What is the InChIKey of N-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine?
The InChIKey is PORQHZGDSJQROK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-11-8-12(2)10-14(9-11)13(3)16-15-6-4-5-7-15/h8-10,13,15-16H,4-7H2,1-3H3.
What are the key properties of N-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine?
N-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine has a molecular weight of 217.36 g/mol, XLogP of 3.90, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3,5-dimethylphenyl)ethyl]cyclopentanamine is sourced from PubChem (CID 81300917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).