N-(4-butylphenyl)-4-(4-methylphenoxy)benzamide

C24H25NO2 — CID 16651108

IUPACN-(4-butylphenyl)-4-(4-methylphenoxy)benzamide
SMILESCCCCc1ccc(NC(=O)c2ccc(Oc3ccc(C)cc3)cc2)cc1
InChIInChI=1S/C24H25NO2/c1-3-4-5-19-8-12-21(13-9-19)25-24(26)20-10-16-23(17-11-20)27-22-14-6-18(2)7-15-22/h6-17H,3-5H2,1-2H3,(H,25,26)
InChIKeyYSWKTLHEQJUSON-UHFFFAOYSA-N
MW359.47 g/mol
LogP6.38
Rot. Bonds7

About N-(4-butylphenyl)-4-(4-methylphenoxy)benzamide

N-(4-butylphenyl)-4-(4-methylphenoxy)benzamide (PubChem CID 16651108) has the molecular formula C24H25NO2 and a molecular weight of 359.47 g/mol. Its IUPAC name is N-(4-butylphenyl)-4-(4-methylphenoxy)benzamide.

Molecular Properties

Compound NameN-(4-butylphenyl)-4-(4-methylphenoxy)benzamide
PubChem CID16651108
Molecular FormulaC24H25NO2
Molecular Weight359.47 g/mol
Exact Mass359.19
IUPAC NameN-(4-butylphenyl)-4-(4-methylphenoxy)benzamide
SMILESCCCCc1ccc(NC(=O)c2ccc(Oc3ccc(C)cc3)cc2)cc1
InChIInChI=1S/C24H25NO2/c1-3-4-5-19-8-12-21(13-9-19)25-24(26)20-10-16-23(17-11-20)27-22-14-6-18(2)7-15-22/h6-17H,3-5H2,1-2H3,(H,25,26)
InChIKeyYSWKTLHEQJUSON-UHFFFAOYSA-N
XLogP6.38
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.47
LogP ≤ 56.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-butyl-N-(4-methylphenyl)benzamide;prop-1-ene
CID 142028227
4-butyl-N-[4-(4-cyanophenoxy)phenyl]benzamide
CID 44723465
N-(4-methoxyphenyl)-4-(4-methylphenoxy)benzamide
CID 16651033
N-(4-ethylphenyl)-4-pentylbenzamide
CID 142206594
N-(4-fluorophenyl)-4-(4-methylphenoxy)benzamide
CID 16651045
4-butoxy-N-[4-(3-phenylpropoxy)phenyl]benzamide
CID 17130195
N-[4-(2-aminoethyl)phenyl]-4-methylbenzamide
CID 28754500
ethane;4-ethyl-N-(4-methylphenyl)benzamide
CID 143234775
4-methyl-N-[4-[[4-[(4-methylbenzoyl)amino]phenyl]methyl]phenyl]benzamide
CID 2330632
1-methyl-4-(4-pentylphenoxy)benzene
CID 142415125
N-(4-butylphenyl)-4-hydroxy-3-methylbenzamide
CID 107676610
N-(4-methylphenyl)-4-(pentanoylamino)benzamide
CID 4630697

Frequently Asked Questions

What is the IUPAC name of N-(4-butylphenyl)-4-(4-methylphenoxy)benzamide?
The IUPAC name of N-(4-butylphenyl)-4-(4-methylphenoxy)benzamide (CID 16651108) is N-(4-butylphenyl)-4-(4-methylphenoxy)benzamide.
What is the SMILES notation for N-(4-butylphenyl)-4-(4-methylphenoxy)benzamide?
The canonical SMILES for N-(4-butylphenyl)-4-(4-methylphenoxy)benzamide is CCCCc1ccc(NC(=O)c2ccc(Oc3ccc(C)cc3)cc2)cc1.
What is the InChIKey of N-(4-butylphenyl)-4-(4-methylphenoxy)benzamide?
The InChIKey is YSWKTLHEQJUSON-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO2/c1-3-4-5-19-8-12-21(13-9-19)25-24(26)20-10-16-23(17-11-20)27-22-14-6-18(2)7-15-22/h6-17H,3-5H2,1-2H3,(H,25,26).
What are the key properties of N-(4-butylphenyl)-4-(4-methylphenoxy)benzamide?
N-(4-butylphenyl)-4-(4-methylphenoxy)benzamide has a molecular weight of 359.47 g/mol, XLogP of 6.38, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-butylphenyl)-4-(4-methylphenoxy)benzamide is sourced from PubChem (CID 16651108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).