1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine

C18H29NO — CID 116762128

IUPAC1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine
SMILESCCNC(CCc1ccccc1)C1(OCC)CCCC1
InChIInChI=1S/C18H29NO/c1-3-19-17(13-12-16-10-6-5-7-11-16)18(20-4-2)14-8-9-15-18/h5-7,10-11,17,19H,3-4,8-9,12-15H2,1-2H3
InChIKeyZYBHMAMXLAITRW-UHFFFAOYSA-N
MW275.44 g/mol
LogP3.95
Rot. Bonds8

About 1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine

1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine (PubChem CID 116762128) has the molecular formula C18H29NO and a molecular weight of 275.44 g/mol. Its IUPAC name is 1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine.

Molecular Properties

Compound Name1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine
PubChem CID116762128
Molecular FormulaC18H29NO
Molecular Weight275.44 g/mol
Exact Mass275.22
IUPAC Name1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine
SMILESCCNC(CCc1ccccc1)C1(OCC)CCCC1
InChIInChI=1S/C18H29NO/c1-3-19-17(13-12-16-10-6-5-7-11-16)18(20-4-2)14-8-9-15-18/h5-7,10-11,17,19H,3-4,8-9,12-15H2,1-2H3
InChIKeyZYBHMAMXLAITRW-UHFFFAOYSA-N
XLogP3.95
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-ethoxycyclopentyl)-N-ethyl-2-(3-methylphenyl)ethanamine
CID 116762276
N-ethyl-1-[1-(2-methylpropyl)cyclopentyl]-3-phenylpropan-1-amine
CID 115793603
N-[(1-ethoxycyclopentyl)-phenylmethyl]ethanamine
CID 116762125
1-(1-ethoxycyclohexyl)-N-ethyl-2-(3-fluorophenyl)ethanamine
CID 116764071
1-(1-ethoxycyclohexyl)-N-ethyl-2-pyridin-3-ylethanamine
CID 116764064
2-(3-chlorophenyl)-1-(1-ethoxycyclohexyl)-N-ethylethanamine
CID 116764102
1-(1-ethoxycyclopentyl)-N-ethylnonan-1-amine
CID 116762131
1-(1-ethoxycyclohexyl)-N-ethyl-5-methylhexan-1-amine
CID 116764152
1-(1-ethoxycycloheptyl)-N-ethylpent-4-en-1-amine
CID 116771028
1-(1-ethoxycyclohexyl)-N-ethylpent-4-yn-1-amine
CID 116764086
1-(1-ethoxycycloheptyl)-N-ethyl-2-thiophen-3-ylethanamine
CID 116771017
1-(1-ethoxycycloheptyl)-N-ethylhex-4-yn-1-amine
CID 116770947

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine?
The IUPAC name of 1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine (CID 116762128) is 1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine.
What is the SMILES notation for 1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine?
The canonical SMILES for 1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine is CCNC(CCc1ccccc1)C1(OCC)CCCC1.
What is the InChIKey of 1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine?
The InChIKey is ZYBHMAMXLAITRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO/c1-3-19-17(13-12-16-10-6-5-7-11-16)18(20-4-2)14-8-9-15-18/h5-7,10-11,17,19H,3-4,8-9,12-15H2,1-2H3.
What are the key properties of 1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine?
1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine has a molecular weight of 275.44 g/mol, XLogP of 3.95, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethoxycyclopentyl)-N-ethyl-3-phenylpropan-1-amine is sourced from PubChem (CID 116762128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).