2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine

C20H33N — CID 115802983

IUPAC2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine
SMILESCCc1ccc(CC(NC)C2(CC(C)C)CCCC2)cc1
InChIInChI=1S/C20H33N/c1-5-17-8-10-18(11-9-17)14-19(21-4)20(15-16(2)3)12-6-7-13-20/h8-11,16,19,21H,5-7,12-15H2,1-4H3
InChIKeyHRXUHWSLSHGYFR-UHFFFAOYSA-N
MW287.49 g/mol
LogP4.99
Rot. Bonds7

About 2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine

2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine (PubChem CID 115802983) has the molecular formula C20H33N and a molecular weight of 287.49 g/mol. Its IUPAC name is 2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine.

Molecular Properties

Compound Name2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine
PubChem CID115802983
Molecular FormulaC20H33N
Molecular Weight287.49 g/mol
Exact Mass287.26
IUPAC Name2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine
SMILESCCc1ccc(CC(NC)C2(CC(C)C)CCCC2)cc1
InChIInChI=1S/C20H33N/c1-5-17-8-10-18(11-9-17)14-19(21-4)20(15-16(2)3)12-6-7-13-20/h8-11,16,19,21H,5-7,12-15H2,1-4H3
InChIKeyHRXUHWSLSHGYFR-UHFFFAOYSA-N
XLogP4.99
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.49
LogP ≤ 54.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-cyclopropyl-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]propan-1-amine
CID 104994759
2-(4-tert-butylphenyl)-N-methyl-1-(1-methylcyclohexyl)ethanamine
CID 106829968
2-(4-chloro-2-fluorophenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine
CID 105055222
2-(4-bromothiophen-2-yl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine
CID 115847589
N-methyl-1-[1-(2-methylpropyl)cyclopentyl]-2-(1,3-thiazol-5-yl)ethanamine
CID 105030314
N-methyl-1-[1-(2-methylpropyl)cyclopentyl]but-3-yn-1-amine
CID 114977002
2-(4-chloro-3-fluorophenyl)-1-(1-ethylcyclopentyl)-N-methylethanamine
CID 107891760
N,3-dimethyl-1-[1-(2-methylpropyl)cyclopentyl]but-3-en-1-amine
CID 105003819
[2-(furan-3-yl)-1-[1-(2-methylpropyl)cyclopentyl]ethyl]hydrazine
CID 105331813
1-(4-ethylphenyl)-2-N,3-N,3-N,3-tetramethylpentane-2,3-diamine
CID 79063641
2-(4-ethylphenyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylethanamine
CID 116767869
1-(1-ethoxycyclopentyl)-N-methyl-2-(4-methylphenyl)ethanamine
CID 116761943

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine?
The IUPAC name of 2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine (CID 115802983) is 2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine.
What is the SMILES notation for 2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine?
The canonical SMILES for 2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine is CCc1ccc(CC(NC)C2(CC(C)C)CCCC2)cc1.
What is the InChIKey of 2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine?
The InChIKey is HRXUHWSLSHGYFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H33N/c1-5-17-8-10-18(11-9-17)14-19(21-4)20(15-16(2)3)12-6-7-13-20/h8-11,16,19,21H,5-7,12-15H2,1-4H3.
What are the key properties of 2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine?
2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine has a molecular weight of 287.49 g/mol, XLogP of 4.99, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenyl)-N-methyl-1-[1-(2-methylpropyl)cyclopentyl]ethanamine is sourced from PubChem (CID 115802983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).