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

C15H23N — CID 64500281

IUPAC3-methyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine
SMILESCc1cccc(CCNC2CCC(C)C2)c1
InChIInChI=1S/C15H23N/c1-12-4-3-5-14(10-12)8-9-16-15-7-6-13(2)11-15/h3-5,10,13,15-16H,6-9,11H2,1-2H3
InChIKeyKPDAGNPUBIHLDU-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.32
Rot. Bonds4

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

3-methyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine (PubChem CID 64500281) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 3-methyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name3-methyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine
PubChem CID64500281
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name3-methyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine
SMILESCc1cccc(CCNC2CCC(C)C2)c1
InChIInChI=1S/C15H23N/c1-12-4-3-5-14(10-12)8-9-16-15-7-6-13(2)11-15/h3-5,10,13,15-16H,6-9,11H2,1-2H3
InChIKeyKPDAGNPUBIHLDU-UHFFFAOYSA-N
XLogP3.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-methyl-N-[2-(3-methylphenyl)ethyl]cyclohexan-1-amine
CID 62313168
3-methyl-N-[2-(3-methylphenyl)ethyl]cyclobutan-1-amine
CID 104859744
cis-(1R,3S)-3-methyl-N-[(3-methylphenyl)methyl]cyclopentan-1-amine
CID 95376410
N-[2-(3-methylphenyl)ethyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
CID 63476591
N-[2-(3-methylphenyl)ethyl]-4-propan-2-ylcycloheptan-1-amine
CID 65091130
3-(4-methylphenyl)-N-[2-(3-methylphenyl)ethyl]cyclobutan-1-amine
CID 62313715
3,3-dimethyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine
CID 80705858
2-methyl-N-[2-(3-methylphenyl)ethyl]cyclohexan-1-amine
CID 55062515
cis-(1S,3R)-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methylcyclopentan-1-amine
CID 30979844
N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-methylcyclopentan-1-amine
CID 64501434
N-[3-(3-methylphenyl)propyl]cyclobutanamine
CID 22492849
3,4-dimethyl-N-[(3-methylphenyl)methyl]cyclohexan-1-amine
CID 64731806

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine?
The IUPAC name of 3-methyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine (CID 64500281) is 3-methyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine.
What is the SMILES notation for 3-methyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine?
The canonical SMILES for 3-methyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine is Cc1cccc(CCNC2CCC(C)C2)c1.
What is the InChIKey of 3-methyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine?
The InChIKey is KPDAGNPUBIHLDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-12-4-3-5-14(10-12)8-9-16-15-7-6-13(2)11-15/h3-5,10,13,15-16H,6-9,11H2,1-2H3.
What are the key properties of 3-methyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine?
3-methyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine has a molecular weight of 217.36 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[2-(3-methylphenyl)ethyl]cyclopentan-1-amine is sourced from PubChem (CID 64500281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).