N-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide

C17H24FNO2 — CID 134060945

IUPACN-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide
SMILESCCN(C(=O)CCc1ccc(OC)c(F)c1)C1CCCC1
InChIInChI=1S/C17H24FNO2/c1-3-19(14-6-4-5-7-14)17(20)11-9-13-8-10-16(21-2)15(18)12-13/h8,10,12,14H,3-7,9,11H2,1-2H3
InChIKeyBOEXKKVKUZJLOE-UHFFFAOYSA-N
MW293.38 g/mol
LogP3.56
Rot. Bonds6

About N-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide

N-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide (PubChem CID 134060945) has the molecular formula C17H24FNO2 and a molecular weight of 293.38 g/mol. Its IUPAC name is N-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide.

Molecular Properties

Compound NameN-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide
PubChem CID134060945
Molecular FormulaC17H24FNO2
Molecular Weight293.38 g/mol
Exact Mass293.18
IUPAC NameN-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide
SMILESCCN(C(=O)CCc1ccc(OC)c(F)c1)C1CCCC1
InChIInChI=1S/C17H24FNO2/c1-3-19(14-6-4-5-7-14)17(20)11-9-13-8-10-16(21-2)15(18)12-13/h8,10,12,14H,3-7,9,11H2,1-2H3
InChIKeyBOEXKKVKUZJLOE-UHFFFAOYSA-N
XLogP3.56
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.38
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopentyl-N-ethyl-3-fluoro-4-methoxybenzamide
CID 86926983
1-(3-fluoro-4-methoxyphenyl)pentan-3-one
CID 43175845
N-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)prop-2-enamide
CID 103597835
3-(3-fluoro-4-methoxyphenyl)-N-(2-hydroxyethyl)-N-methylpropanamide
CID 110886057
N-cyclopropyl-N-ethyl-2-(3-fluoro-4-methoxyanilino)acetamide
CID 61488261
N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-3-(3,4-dimethoxyphenyl)propanamide
CID 39738565
N-cyclohexyl-N-ethyl-3-phenylpropanamide
CID 670110
2-[4-(2-aminoethyl)-2-methoxyphenoxy]-N-cyclopropyl-N-ethylacetamide
CID 61488503
4-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]benzoic acid
CID 119179256
3-(3-fluoro-4-methoxyphenyl)propanoic acid;propanedioic acid
CID 67624266
N-cyclopropyl-3-(3,4-dimethoxyphenyl)-N-(4-ethylcyclohexyl)propanamide
CID 55594402
4-[3-(3-fluoro-4-methoxyphenyl)propanoyl-methylamino]butanoic acid
CID 119173051

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide?
The IUPAC name of N-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide (CID 134060945) is N-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide.
What is the SMILES notation for N-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide?
The canonical SMILES for N-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide is CCN(C(=O)CCc1ccc(OC)c(F)c1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide?
The InChIKey is BOEXKKVKUZJLOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24FNO2/c1-3-19(14-6-4-5-7-14)17(20)11-9-13-8-10-16(21-2)15(18)12-13/h8,10,12,14H,3-7,9,11H2,1-2H3.
What are the key properties of N-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide?
N-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide has a molecular weight of 293.38 g/mol, XLogP of 3.56, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-ethyl-3-(3-fluoro-4-methoxyphenyl)propanamide is sourced from PubChem (CID 134060945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).