N-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide

C17H25NO — CID 19221387

IUPACN-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide
SMILESCC(C)c1ccc(CCC(=O)NC2CCCC2)cc1
InChIInChI=1S/C17H25NO/c1-13(2)15-10-7-14(8-11-15)9-12-17(19)18-16-5-3-4-6-16/h7-8,10-11,13,16H,3-6,9,12H2,1-2H3,(H,18,19)
InChIKeyVMRPKRGUBWKIQO-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.80
Rot. Bonds5

About N-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide

N-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide (PubChem CID 19221387) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is N-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide
PubChem CID19221387
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC NameN-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide
SMILESCC(C)c1ccc(CCC(=O)NC2CCCC2)cc1
InChIInChI=1S/C17H25NO/c1-13(2)15-10-7-14(8-11-15)9-12-17(19)18-16-5-3-4-6-16/h7-8,10-11,13,16H,3-6,9,12H2,1-2H3,(H,18,19)
InChIKeyVMRPKRGUBWKIQO-UHFFFAOYSA-N
XLogP3.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1R,2R,4S)-2-bicyclo[2.2.1]heptanyl]-3-(4-propan-2-ylphenyl)propanamide
CID 41455014
N-methyl-3-(4-propan-2-ylphenyl)propanamide
CID 41455606
N-[2-[3-(4-propan-2-ylphenyl)propanoylamino]ethyl]cyclohexanecarboxamide
CID 55806046
N-cyclooctyl-3-[4-(methylsulfamoyl)phenyl]propanamide
CID 51180741
N-cyclohexyl-3-[[5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide
CID 46683382
3-(4-aminophenyl)-N-[(1S)-1-cyclopentylethyl]propanamide
CID 115341674
2-[benzyl-[3-(4-propan-2-ylphenyl)propanoyl]amino]-N-cyclopentyl-3-phenylpropanamide
CID 133263599
3-[4-(1-aminocyclopropyl)phenyl]-N-cycloheptylpropanamide
CID 115055960
(2R)-N-cyclohexyl-2-[2-phenylethyl-[3-(4-propan-2-ylphenyl)propanoyl]amino]butanamide
CID 100607646
N-cyclopentyl-2-[(2-fluorophenyl)methyl-[3-(4-propan-2-ylphenyl)propanoyl]amino]propanamide
CID 133198748
(2S)-N-cyclohexyl-2-[(2,6-dichlorophenyl)methyl-[3-(4-propan-2-ylphenyl)propanoyl]amino]propanamide
CID 100505953
(2R)-N-cyclohexyl-2-[(3,4-dichlorophenyl)methyl-[3-(4-propan-2-ylphenyl)propanoyl]amino]propanamide
CID 100500438

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide?
The IUPAC name of N-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide (CID 19221387) is N-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide.
What is the SMILES notation for N-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide?
The canonical SMILES for N-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide is CC(C)c1ccc(CCC(=O)NC2CCCC2)cc1.
What is the InChIKey of N-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide?
The InChIKey is VMRPKRGUBWKIQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-13(2)15-10-7-14(8-11-15)9-12-17(19)18-16-5-3-4-6-16/h7-8,10-11,13,16H,3-6,9,12H2,1-2H3,(H,18,19).
What are the key properties of N-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide?
N-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide has a molecular weight of 259.39 g/mol, XLogP of 3.80, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-(4-propan-2-ylphenyl)propanamide is sourced from PubChem (CID 19221387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).