N-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide

C18H27NO — CID 55771489

IUPACN-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide
SMILESCc1ccc(CCCC(=O)NCC2CCCCC2)cc1
InChIInChI=1S/C18H27NO/c1-15-10-12-16(13-11-15)8-5-9-18(20)19-14-17-6-3-2-4-7-17/h10-13,17H,2-9,14H2,1H3,(H,19,20)
InChIKeyWKKYYXRQTGUAJA-UHFFFAOYSA-N
MW273.42 g/mol
LogP4.01
Rot. Bonds6

About N-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide

N-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide (PubChem CID 55771489) has the molecular formula C18H27NO and a molecular weight of 273.42 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide
PubChem CID55771489
Molecular FormulaC18H27NO
Molecular Weight273.42 g/mol
Exact Mass273.21
IUPAC NameN-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide
SMILESCc1ccc(CCCC(=O)NCC2CCCCC2)cc1
InChIInChI=1S/C18H27NO/c1-15-10-12-16(13-11-15)8-5-9-18(20)19-14-17-6-3-2-4-7-17/h10-13,17H,2-9,14H2,1H3,(H,19,20)
InChIKeyWKKYYXRQTGUAJA-UHFFFAOYSA-N
XLogP4.01
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-cyclopentylethyl)-4-(4-methylphenyl)butanamide
CID 55774639
N-(2-cyclopentyl-2-hydroxyethyl)-4-(4-methylphenyl)butanamide
CID 111425697
3-(4-aminophenyl)-N-(cyclopentylmethyl)propanamide
CID 43371351
3-(4-methylphenyl)-N-[2-oxo-2-(piperidin-3-ylmethylamino)ethyl]propanamide
CID 119462114
N-(2,2-dimethylpropyl)-4-(4-methylphenyl)butanamide
CID 177221343
4-(4-methylphenyl)-N-(2-piperidin-1-ylpropyl)butanamide
CID 110301716
[2-(cyclohexylmethylamino)-2-oxoethyl] 3-(4-methylphenyl)sulfanylpropanoate
CID 2458106
N-[(4-aminocyclohexyl)methyl]-2-(4-methylphenyl)acetamide
CID 106124207
N-(cyclobutylmethyl)-5-(2,5-dimethylphenoxy)pentanamide
CID 47723201
1-(3-cyclopentylpropyl)-4-methylbenzene
CID 149264652
2-(4-methylphenyl)-N-(piperidin-4-ylmethyl)acetamide
CID 43152403
1-[4-(3-cyclopentylpropanoyl)piperazin-1-yl]-5-(4-methylphenyl)pentan-1-one
CID 60602172

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide?
The IUPAC name of N-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide (CID 55771489) is N-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide.
What is the SMILES notation for N-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide?
The canonical SMILES for N-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide is Cc1ccc(CCCC(=O)NCC2CCCCC2)cc1.
What is the InChIKey of N-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide?
The InChIKey is WKKYYXRQTGUAJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO/c1-15-10-12-16(13-11-15)8-5-9-18(20)19-14-17-6-3-2-4-7-17/h10-13,17H,2-9,14H2,1H3,(H,19,20).
What are the key properties of N-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide?
N-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide has a molecular weight of 273.42 g/mol, XLogP of 4.01, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-4-(4-methylphenyl)butanamide is sourced from PubChem (CID 55771489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).