2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine

C15H23N — CID 81363310

IUPAC2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine
SMILESCc1cccc([C@@H](C)NC2CCCC2C)c1
InChIInChI=1S/C15H23N/c1-11-6-4-8-14(10-11)13(3)16-15-9-5-7-12(15)2/h4,6,8,10,12-13,15-16H,5,7,9H2,1-3H3/t12?,13-,15?/m1/s1
InChIKeyORPFYWUGFHCYJH-JVWICGRDSA-N
MW217.36 g/mol
LogP3.83
Rot. Bonds3

About 2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine

2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine (PubChem CID 81363310) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine
PubChem CID81363310
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine
SMILESCc1cccc([C@@H](C)NC2CCCC2C)c1
InChIInChI=1S/C15H23N/c1-11-6-4-8-14(10-11)13(3)16-15-9-5-7-12(15)2/h4,6,8,10,12-13,15-16H,5,7,9H2,1-3H3/t12?,13-,15?/m1/s1
InChIKeyORPFYWUGFHCYJH-JVWICGRDSA-N
XLogP3.83
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 ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-(3-chlorophenyl)ethyl]-2-methylcyclopentan-1-amine
CID 63277317
cis-(1R,2S)-2-methyl-N-[(1S)-1-phenylethyl]cyclopentan-1-amine
CID 95377362
trans-(1S,2S)-2-methyl-N-[(1S)-1-phenylethyl]cyclopentan-1-amine
CID 95377360
2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]thian-3-amine
CID 81364140
N-[(1S)-1-(3-methylphenyl)ethyl]-2-methylsulfonylcyclopentan-1-amine
CID 81364185
2,4,4-trimethyl-N-[(1S)-1-(3-methylphenyl)ethyl]cyclohexan-1-amine
CID 81360676
N-[(1S)-1-(3-fluorophenyl)ethyl]-2,3-dimethylcyclohexan-1-amine
CID 81365854
N-[(1S)-1-(3-chlorophenyl)ethyl]-2,3-dimethylcyclohexan-1-amine
CID 81366645
N-[(1S)-1-(3-methylphenyl)ethyl]-2-piperidin-2-ylcyclopentan-1-amine
CID 81367096
5-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]-2-propan-2-ylcyclohexan-1-amine
CID 81364343
N-[(1S)-1-(3-methylphenyl)ethyl]-2-pyrrolidin-2-ylcyclohexan-1-amine
CID 81369615
N-[(1S)-1-(4-chlorophenyl)ethyl]-2-methylcyclopentan-1-amine
CID 81353352

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine?
The IUPAC name of 2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine (CID 81363310) is 2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine.
What is the SMILES notation for 2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine?
The canonical SMILES for 2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine is Cc1cccc([C@@H](C)NC2CCCC2C)c1.
What is the InChIKey of 2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine?
The InChIKey is ORPFYWUGFHCYJH-JVWICGRDSA-N. The full InChI is InChI=1S/C15H23N/c1-11-6-4-8-14(10-11)13(3)16-15-9-5-7-12(15)2/h4,6,8,10,12-13,15-16H,5,7,9H2,1-3H3/t12?,13-,15?/m1/s1.
What are the key properties of 2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine?
2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine has a molecular weight of 217.36 g/mol, XLogP of 3.83, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(1R)-1-(3-methylphenyl)ethyl]cyclopentan-1-amine is sourced from PubChem (CID 81363310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).