2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine

C16H25N — CID 115802920

IUPAC2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine
SMILESCCc1ccc(CC(N)C2(C)CCCC2)cc1
InChIInChI=1S/C16H25N/c1-3-13-6-8-14(9-7-13)12-15(17)16(2)10-4-5-11-16/h6-9,15H,3-5,10-12,17H2,1-2H3
InChIKeyHWOOHVAWMFGTRG-UHFFFAOYSA-N
MW231.38 g/mol
LogP3.70
Rot. Bonds4

About 2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine

2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine (PubChem CID 115802920) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is 2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine.

Molecular Properties

Compound Name2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine
PubChem CID115802920
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC Name2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine
SMILESCCc1ccc(CC(N)C2(C)CCCC2)cc1
InChIInChI=1S/C16H25N/c1-3-13-6-8-14(9-7-13)12-15(17)16(2)10-4-5-11-16/h6-9,15H,3-5,10-12,17H2,1-2H3
InChIKeyHWOOHVAWMFGTRG-UHFFFAOYSA-N
XLogP3.70
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(5-ethyl-2-pyridinyl)-1-(1-methylcyclohexyl)ethanamine
CID 106830386
2-(3,4-dimethylphenyl)-1-(1-methylcyclohexyl)ethanamine
CID 106827638
2-(3,4-dichlorophenyl)-1-(1-methylcyclohexyl)ethanamine
CID 106827645
2-(3,4-dimethoxyphenyl)-1-(1-methylcyclohexyl)ethanamine
CID 106827566
2-(3-chlorophenyl)-1-(1-methylcyclohexyl)ethanamine
CID 106827634
2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclopentyl)ethanamine
CID 115822094
1-(1-methylcyclopentyl)propan-1-amine
CID 114979259
2-(1-ethylpyrazol-4-yl)-1-(1-methylcyclohexyl)ethanamine
CID 106829887
2-(2-bromo-5-fluorophenyl)-1-(1-methylcyclopentyl)ethanamine
CID 115843507
2-(3,5-difluorophenyl)-1-(1-methylcyclopropyl)ethanamine
CID 105406717
1-(1-ethylcyclopentyl)-2-[4-(trifluoromethoxy)phenyl]ethanamine
CID 115843446
3-(4-methoxyphenyl)-1-(1-methylcyclohexyl)propan-1-amine
CID 106830149

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine?
The IUPAC name of 2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine (CID 115802920) is 2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine.
What is the SMILES notation for 2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine?
The canonical SMILES for 2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine is CCc1ccc(CC(N)C2(C)CCCC2)cc1.
What is the InChIKey of 2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine?
The InChIKey is HWOOHVAWMFGTRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-3-13-6-8-14(9-7-13)12-15(17)16(2)10-4-5-11-16/h6-9,15H,3-5,10-12,17H2,1-2H3.
What are the key properties of 2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine?
2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine has a molecular weight of 231.38 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenyl)-1-(1-methylcyclopentyl)ethanamine is sourced from PubChem (CID 115802920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).