2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine

C18H29NO — CID 63505858

IUPAC2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine
SMILESCCNC(CC1CCCC1)c1cc(C)ccc1OCC
InChIInChI=1S/C18H29NO/c1-4-19-17(13-15-8-6-7-9-15)16-12-14(3)10-11-18(16)20-5-2/h10-12,15,17,19H,4-9,13H2,1-3H3
InChIKeyYMDOPKPOFKQQKY-UHFFFAOYSA-N
MW275.44 g/mol
LogP4.62
Rot. Bonds7

About 2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine

2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine (PubChem CID 63505858) has the molecular formula C18H29NO and a molecular weight of 275.44 g/mol. Its IUPAC name is 2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine.

Molecular Properties

Compound Name2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine
PubChem CID63505858
Molecular FormulaC18H29NO
Molecular Weight275.44 g/mol
Exact Mass275.22
IUPAC Name2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine
SMILESCCNC(CC1CCCC1)c1cc(C)ccc1OCC
InChIInChI=1S/C18H29NO/c1-4-19-17(13-15-8-6-7-9-15)16-12-14(3)10-11-18(16)20-5-2/h10-12,15,17,19H,4-9,13H2,1-3H3
InChIKeyYMDOPKPOFKQQKY-UHFFFAOYSA-N
XLogP4.62
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopentyl-N-ethyl-1-(2-methoxy-5-methylphenyl)ethanamine
CID 60778145
2-cycloheptyl-N-ethyl-1-(2-methoxy-5-methylphenyl)ethanamine
CID 114457630
2-cycloheptyl-1-(2,5-dimethylphenyl)-N-ethylethanamine
CID 114457580
1-(2-ethoxy-5-methylphenyl)-N-ethylpropan-1-amine
CID 62301989
3-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-methylpropan-1-amine
CID 63506516
2-cyclohexyl-N-ethyl-1-(2-fluoro-5-methylphenyl)ethanamine
CID 115842003
1-[2-(cyclopentylmethoxy)-5-methylphenyl]-N-ethylethanamine
CID 61344981
1-(2-chloro-4-methylphenyl)-2-cyclopentyl-N-ethylethanamine
CID 106857386
2-cyclopropyl-1-(2-ethoxy-5-methylphenyl)-N-ethylpropan-1-amine
CID 83154688
1-(2-bromo-5-methylphenyl)-2-cyclopropyl-N-ethylethanamine
CID 104986405
2-[chloro(cyclopentyl)methyl]-1-ethoxy-4-methylbenzene
CID 63447510
1-(2-ethoxy-5-methylphenyl)-N-ethylheptan-1-amine
CID 114752520

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine?
The IUPAC name of 2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine (CID 63505858) is 2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine.
What is the SMILES notation for 2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine?
The canonical SMILES for 2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine is CCNC(CC1CCCC1)c1cc(C)ccc1OCC.
What is the InChIKey of 2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine?
The InChIKey is YMDOPKPOFKQQKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO/c1-4-19-17(13-15-8-6-7-9-15)16-12-14(3)10-11-18(16)20-5-2/h10-12,15,17,19H,4-9,13H2,1-3H3.
What are the key properties of 2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine?
2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine has a molecular weight of 275.44 g/mol, XLogP of 4.62, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(2-ethoxy-5-methylphenyl)-N-ethylethanamine is sourced from PubChem (CID 63505858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).