N-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine

C18H29N — CID 65411617

IUPACN-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine
SMILESCCNC(c1ccc(CC)cc1)C1CCC(CC)C1
InChIInChI=1S/C18H29N/c1-4-14-7-10-16(11-8-14)18(19-6-3)17-12-9-15(5-2)13-17/h7-8,10-11,15,17-19H,4-6,9,12-13H2,1-3H3
InChIKeyAKMUYBXTMIVSQX-UHFFFAOYSA-N
MW259.44 g/mol
LogP4.73
Rot. Bonds6

About N-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine

N-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine (PubChem CID 65411617) has the molecular formula C18H29N and a molecular weight of 259.44 g/mol. Its IUPAC name is N-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine
PubChem CID65411617
Molecular FormulaC18H29N
Molecular Weight259.44 g/mol
Exact Mass259.23
IUPAC NameN-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine
SMILESCCNC(c1ccc(CC)cc1)C1CCC(CC)C1
InChIInChI=1S/C18H29N/c1-4-14-7-10-16(11-8-14)18(19-6-3)17-12-9-15(5-2)13-17/h7-8,10-11,15,17-19H,4-6,9,12-13H2,1-3H3
InChIKeyAKMUYBXTMIVSQX-UHFFFAOYSA-N
XLogP4.73
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.44
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(3,4-dimethylphenyl)-(3-ethylcyclopentyl)methyl]ethanamine
CID 65411811
N-[(3-ethylcyclopentyl)-(4-methylphenyl)methyl]propan-1-amine
CID 65410254
N-[cyclopropyl-(4-propylphenyl)methyl]ethanamine
CID 43491617
N-[(3-ethylcyclopentyl)-phenylmethyl]propan-1-amine
CID 65412412
N-[(3-ethylcyclopentyl)-(1-methylpyrazol-4-yl)methyl]ethanamine
CID 65410246
[(3-ethylcyclopentyl)-(4-propan-2-ylphenyl)methyl]hydrazine
CID 105233695
N-ethyl-1-(3-ethylcyclohexyl)-2-(4-ethylphenyl)ethanamine
CID 65414953
N-[(3-ethylcyclopentyl)-(5-fluoro-2-methylphenyl)methyl]ethanamine
CID 65411816
1-(4-tert-butylphenyl)-1-(3-ethylcyclopentyl)-N-methylmethanamine
CID 65412580
N-[(4-bromophenyl)-cyclopropylmethyl]ethanamine
CID 43488686
N-[(4-ethylcyclohexyl)methyl]-1-(4-ethylphenyl)ethanamine
CID 63452140
N-[(3-bromo-4-chlorophenyl)-(3-ethylcyclohexyl)methyl]ethanamine
CID 115567623

Frequently Asked Questions

What is the IUPAC name of N-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine?
The IUPAC name of N-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine (CID 65411617) is N-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine.
What is the SMILES notation for N-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine?
The canonical SMILES for N-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine is CCNC(c1ccc(CC)cc1)C1CCC(CC)C1.
What is the InChIKey of N-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine?
The InChIKey is AKMUYBXTMIVSQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N/c1-4-14-7-10-16(11-8-14)18(19-6-3)17-12-9-15(5-2)13-17/h7-8,10-11,15,17-19H,4-6,9,12-13H2,1-3H3.
What are the key properties of N-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine?
N-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine has a molecular weight of 259.44 g/mol, XLogP of 4.73, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-ethylcyclopentyl)-(4-ethylphenyl)methyl]ethanamine is sourced from PubChem (CID 65411617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).