N-(4-butylphenyl)-3-cyclopentylpropanamide

C18H27NO — CID 4076618

IUPACN-(4-butylphenyl)-3-cyclopentylpropanamide
SMILESCCCCc1ccc(NC(=O)CCC2CCCC2)cc1
InChIInChI=1S/C18H27NO/c1-2-3-6-16-9-12-17(13-10-16)19-18(20)14-11-15-7-4-5-8-15/h9-10,12-13,15H,2-8,11,14H2,1H3,(H,19,20)
InChIKeyPKQHOAPEXRAMRP-UHFFFAOYSA-N
MW273.42 g/mol
LogP4.94
Rot. Bonds7

About N-(4-butylphenyl)-3-cyclopentylpropanamide

N-(4-butylphenyl)-3-cyclopentylpropanamide (PubChem CID 4076618) has the molecular formula C18H27NO and a molecular weight of 273.42 g/mol. Its IUPAC name is N-(4-butylphenyl)-3-cyclopentylpropanamide.

Molecular Properties

Compound NameN-(4-butylphenyl)-3-cyclopentylpropanamide
PubChem CID4076618
Molecular FormulaC18H27NO
Molecular Weight273.42 g/mol
Exact Mass273.21
IUPAC NameN-(4-butylphenyl)-3-cyclopentylpropanamide
SMILESCCCCc1ccc(NC(=O)CCC2CCCC2)cc1
InChIInChI=1S/C18H27NO/c1-2-3-6-16-9-12-17(13-10-16)19-18(20)14-11-15-7-4-5-8-15/h9-10,12-13,15H,2-8,11,14H2,1H3,(H,19,20)
InChIKeyPKQHOAPEXRAMRP-UHFFFAOYSA-N
XLogP4.94
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-(2-aminoethyl)phenyl]-3-cyclohexylpropanamide
CID 62302187
N-(4-acetylphenyl)-3-cyclopentylpropanamide
CID 835633
3-cyclohexyl-N-[4-(dibutylsulfamoyl)phenyl]propanamide
CID 3715174
3-cyclohexyl-N-(4-propoxyphenyl)propanamide
CID 110493363
3-cyclopentyl-N-(4-methoxyphenyl)propanamide
CID 835546
N-(4-butylphenyl)-4-phenylbutanamide
CID 7313944
3-cyclohexyl-N-(4-sulfanylphenyl)propanamide
CID 27125888
N-(4-heptylphenyl)heptanamide
CID 101077737
N-(4-butylphenyl)-4-(3-cyclopropylpropanoyl)-1,4-diazepane-1-carboxamide
CID 24948113
3-cyclopentyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]propanamide
CID 38166746
N-[4-(4-cyclobutylbutyl)phenyl]acetamide
CID 130280678
N-(4-butylphenyl)-3-methylsulfonylpropanamide
CID 127504583

Frequently Asked Questions

What is the IUPAC name of N-(4-butylphenyl)-3-cyclopentylpropanamide?
The IUPAC name of N-(4-butylphenyl)-3-cyclopentylpropanamide (CID 4076618) is N-(4-butylphenyl)-3-cyclopentylpropanamide.
What is the SMILES notation for N-(4-butylphenyl)-3-cyclopentylpropanamide?
The canonical SMILES for N-(4-butylphenyl)-3-cyclopentylpropanamide is CCCCc1ccc(NC(=O)CCC2CCCC2)cc1.
What is the InChIKey of N-(4-butylphenyl)-3-cyclopentylpropanamide?
The InChIKey is PKQHOAPEXRAMRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO/c1-2-3-6-16-9-12-17(13-10-16)19-18(20)14-11-15-7-4-5-8-15/h9-10,12-13,15H,2-8,11,14H2,1H3,(H,19,20).
What are the key properties of N-(4-butylphenyl)-3-cyclopentylpropanamide?
N-(4-butylphenyl)-3-cyclopentylpropanamide has a molecular weight of 273.42 g/mol, XLogP of 4.94, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-butylphenyl)-3-cyclopentylpropanamide is sourced from PubChem (CID 4076618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).