3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine

C18H29NO — CID 116773746

IUPAC3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine
SMILESCCNC(CC1CCCC1)C(OCC)c1ccccc1
InChIInChI=1S/C18H29NO/c1-3-19-17(14-15-10-8-9-11-15)18(20-4-2)16-12-6-5-7-13-16/h5-7,12-13,15,17-19H,3-4,8-11,14H2,1-2H3
InChIKeyHCXWACCRGQJEPY-UHFFFAOYSA-N
MW275.44 g/mol
LogP4.32
Rot. Bonds8

About 3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine

3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine (PubChem CID 116773746) has the molecular formula C18H29NO and a molecular weight of 275.44 g/mol. Its IUPAC name is 3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine.

Molecular Properties

Compound Name3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine
PubChem CID116773746
Molecular FormulaC18H29NO
Molecular Weight275.44 g/mol
Exact Mass275.22
IUPAC Name3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine
SMILESCCNC(CC1CCCC1)C(OCC)c1ccccc1
InChIInChI=1S/C18H29NO/c1-3-19-17(14-15-10-8-9-11-15)18(20-4-2)16-12-6-5-7-13-16/h5-7,12-13,15,17-19H,3-4,8-11,14H2,1-2H3
InChIKeyHCXWACCRGQJEPY-UHFFFAOYSA-N
XLogP4.32
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 ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-cyclopropyl-1-ethoxy-1-phenylpropan-2-yl)hydrazine
CID 105279201
(1-cyclopentyl-2-ethoxy-2-phenylethyl)hydrazine
CID 105279234
1-ethoxy-N-ethyl-1-phenylheptan-2-amine
CID 116773710
1-ethoxy-N-ethyl-5,5-dimethyl-1-phenylhexan-2-amine
CID 116773735
1-cyclohexyl-N-ethyl-2-methoxy-2-phenylethanamine
CID 116773025
1-cyclohexyl-3-ethoxy-N-ethylpentan-2-amine
CID 116717017
(1-ethoxy-1-phenyl-3-propan-2-yloxypropan-2-yl)hydrazine
CID 105279365
1-ethoxy-N-ethyl-3-(furan-3-yl)-1-phenylpropan-2-amine
CID 116773731
[3-(2-bicyclo[2.2.1]heptanyl)-1-ethoxy-1-phenylpropan-2-yl]hydrazine
CID 105279376
1-ethoxy-N-ethyl-1-phenyl-3-(1,3-thiazol-5-yl)propan-2-amine
CID 116773805
2-(cyclohexylmethoxy)-N-ethyl-1-phenylpropan-1-amine
CID 62383534
(2-cyclopentyl-1-phenylethyl)benzene
CID 138978826

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine?
The IUPAC name of 3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine (CID 116773746) is 3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine.
What is the SMILES notation for 3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine?
The canonical SMILES for 3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine is CCNC(CC1CCCC1)C(OCC)c1ccccc1.
What is the InChIKey of 3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine?
The InChIKey is HCXWACCRGQJEPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO/c1-3-19-17(14-15-10-8-9-11-15)18(20-4-2)16-12-6-5-7-13-16/h5-7,12-13,15,17-19H,3-4,8-11,14H2,1-2H3.
What are the key properties of 3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine?
3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine has a molecular weight of 275.44 g/mol, XLogP of 4.32, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-ethoxy-N-ethyl-1-phenylpropan-2-amine is sourced from PubChem (CID 116773746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).