3-(3-ethylphenyl)-3-methylcyclopentan-1-amine

C14H21N — CID 116538959

IUPAC3-(3-ethylphenyl)-3-methylcyclopentan-1-amine
SMILESCCc1cccc(C2(C)CCC(N)C2)c1
InChIInChI=1S/C14H21N/c1-3-11-5-4-6-12(9-11)14(2)8-7-13(15)10-14/h4-6,9,13H,3,7-8,10,15H2,1-2H3
InChIKeyXXEOVPMIYWDCDR-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.02
Rot. Bonds2

About 3-(3-ethylphenyl)-3-methylcyclopentan-1-amine

3-(3-ethylphenyl)-3-methylcyclopentan-1-amine (PubChem CID 116538959) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 3-(3-ethylphenyl)-3-methylcyclopentan-1-amine.

Molecular Properties

Compound Name3-(3-ethylphenyl)-3-methylcyclopentan-1-amine
PubChem CID116538959
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name3-(3-ethylphenyl)-3-methylcyclopentan-1-amine
SMILESCCc1cccc(C2(C)CCC(N)C2)c1
InChIInChI=1S/C14H21N/c1-3-11-5-4-6-12(9-11)14(2)8-7-13(15)10-14/h4-6,9,13H,3,7-8,10,15H2,1-2H3
InChIKeyXXEOVPMIYWDCDR-UHFFFAOYSA-N
XLogP3.02
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(3-ethylphenyl)-3-methyl-N-propylcyclopentan-1-amine
CID 116539851
cis-(1R,3R)-3-methyl-3-phenylcyclopentan-1-amine;hydrochloride
CID 173470709
1-ethyl-3-[1-(3-ethylphenyl)-4-methylcyclohexyl]benzene
CID 22420628
3-methyl-3-(4-phenylphenyl)cyclopentan-1-amine
CID 116538694
3-(furan-3-yl)-3-methylcyclopentan-1-amine
CID 116538755
3-methyl-3-naphthalen-1-ylcyclopentan-1-amine
CID 116538934
3-methyl-3-[3-(2-methylpropyl)phenyl]-N-propylcyclopentan-1-amine
CID 116545842
1-ethyl-3-(1-phenylcyclopropyl)benzene
CID 142848757
3-(4-methoxyphenyl)-3-methylcyclopentan-1-amine
CID 116538662
3-(2,3-difluorophenyl)-3-methylcyclopentan-1-amine
CID 116538869
1-[(1R)-2,2-dimethylcyclopropyl]-3-ethylbenzene
CID 142058084
3-[(3-chlorophenyl)methyl]-3-methylcyclopentan-1-amine
CID 116538936

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethylphenyl)-3-methylcyclopentan-1-amine?
The IUPAC name of 3-(3-ethylphenyl)-3-methylcyclopentan-1-amine (CID 116538959) is 3-(3-ethylphenyl)-3-methylcyclopentan-1-amine.
What is the SMILES notation for 3-(3-ethylphenyl)-3-methylcyclopentan-1-amine?
The canonical SMILES for 3-(3-ethylphenyl)-3-methylcyclopentan-1-amine is CCc1cccc(C2(C)CCC(N)C2)c1.
What is the InChIKey of 3-(3-ethylphenyl)-3-methylcyclopentan-1-amine?
The InChIKey is XXEOVPMIYWDCDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-3-11-5-4-6-12(9-11)14(2)8-7-13(15)10-14/h4-6,9,13H,3,7-8,10,15H2,1-2H3.
What are the key properties of 3-(3-ethylphenyl)-3-methylcyclopentan-1-amine?
3-(3-ethylphenyl)-3-methylcyclopentan-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.02, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethylphenyl)-3-methylcyclopentan-1-amine is sourced from PubChem (CID 116538959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).