3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide

C17H25NO2 — CID 78771407

IUPAC3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide
SMILESCOc1ccccc1C(C)NC(=O)CCC1CCCC1
InChIInChI=1S/C17H25NO2/c1-13(15-9-5-6-10-16(15)20-2)18-17(19)12-11-14-7-3-4-8-14/h5-6,9-10,13-14H,3-4,7-8,11-12H2,1-2H3,(H,18,19)
InChIKeyHMMNSRRDOLEVJE-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.84
Rot. Bonds6

About 3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide

3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide (PubChem CID 78771407) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is 3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide
PubChem CID78771407
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC Name3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide
SMILESCOc1ccccc1C(C)NC(=O)CCC1CCCC1
InChIInChI=1S/C17H25NO2/c1-13(15-9-5-6-10-16(15)20-2)18-17(19)12-11-14-7-3-4-8-14/h5-6,9-10,13-14H,3-4,7-8,11-12H2,1-2H3,(H,18,19)
InChIKeyHMMNSRRDOLEVJE-UHFFFAOYSA-N
XLogP3.84
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclohexyl-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 51144509
4-cyclohexyl-N-[1-(2,5-dimethoxyphenyl)ethyl]butanamide
CID 85020035
N-[2-[[(1R)-1-(2-methoxyphenyl)ethyl]amino]-2-oxoethyl]cyclohexanecarboxamide
CID 8000352
3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide
CID 62834607
N-(2-cyclohexylethyl)-1-(2-methoxyphenyl)ethanamine
CID 54931731
N-[(1R)-1-(2-methoxyphenyl)ethyl]-4-(methylamino)butanamide
CID 81387871
2-[4-(hydroxymethyl)piperidin-1-yl]-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 110891543
2-(aminomethyl)-N-[(1S)-1-(2-methoxyphenyl)ethyl]cyclohexane-1-carboxamide
CID 81390427
3-[4-(cyclohexylsulfamoyl)phenyl]-N-[1-(2-methoxyphenyl)ethyl]propanamide
CID 43873814
3-(4-chlorophenyl)sulfanyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]propanamide
CID 26618385
N-[(1S)-1-(2-chlorophenyl)ethyl]-3-piperidin-4-ylpropanamide
CID 81379365
1-[2-[1-(2-methoxyphenyl)ethylamino]-2-oxoethyl]pyrrolidine-2-carboxylic acid
CID 119909597

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide?
The IUPAC name of 3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide (CID 78771407) is 3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide.
What is the SMILES notation for 3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide?
The canonical SMILES for 3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide is COc1ccccc1C(C)NC(=O)CCC1CCCC1.
What is the InChIKey of 3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide?
The InChIKey is HMMNSRRDOLEVJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-13(15-9-5-6-10-16(15)20-2)18-17(19)12-11-14-7-3-4-8-14/h5-6,9-10,13-14H,3-4,7-8,11-12H2,1-2H3,(H,18,19).
What are the key properties of 3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide?
3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide has a molecular weight of 275.39 g/mol, XLogP of 3.84, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide is sourced from PubChem (CID 78771407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).