N-methyl-4-(4-pentan-3-ylphenoxy)benzamide

C19H23NO2 — CID 142415379

IUPACN-methyl-4-(4-pentan-3-ylphenoxy)benzamide
SMILESCCC(CC)c1ccc(Oc2ccc(C(=O)NC)cc2)cc1
InChIInChI=1S/C19H23NO2/c1-4-14(5-2)15-6-10-17(11-7-15)22-18-12-8-16(9-13-18)19(21)20-3/h6-14H,4-5H2,1-3H3,(H,20,21)
InChIKeyARSABKDYIJSXFY-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.74
Rot. Bonds6

About N-methyl-4-(4-pentan-3-ylphenoxy)benzamide

N-methyl-4-(4-pentan-3-ylphenoxy)benzamide (PubChem CID 142415379) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-methyl-4-(4-pentan-3-ylphenoxy)benzamide.

Molecular Properties

Compound NameN-methyl-4-(4-pentan-3-ylphenoxy)benzamide
PubChem CID142415379
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-methyl-4-(4-pentan-3-ylphenoxy)benzamide
SMILESCCC(CC)c1ccc(Oc2ccc(C(=O)NC)cc2)cc1
InChIInChI=1S/C19H23NO2/c1-4-14(5-2)15-6-10-17(11-7-15)22-18-12-8-16(9-13-18)19(21)20-3/h6-14H,4-5H2,1-3H3,(H,20,21)
InChIKeyARSABKDYIJSXFY-UHFFFAOYSA-N
XLogP4.74
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-4-(4-pentan-3-ylphenoxy)benzamide 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

4-(4-aminophenoxy)-N-methylbenzamide
CID 131636828
N-methyl-4-[4-(trifluoromethyl)phenoxy]benzamide
CID 146305988
[4-[4-(2-hydroxyphenoxy)benzoyl]phenyl]-(4-pentan-3-ylphenyl)methanone
CID 134502768
4-ethoxy-N-(2-phenylbutyl)benzamide
CID 17462842
[4-(methylcarbamoyl)phenoxy]carbonylazanide;yttrium(3+)
CID 20789579
ethyl 2,3-dihydroxy-3-[4-(methylcarbamoyl)phenyl]propanoate
CID 171866592
N-methyl-4-[2-(methylamino)ethoxy]benzamide
CID 19915722
4-heptoxy-N-methylbenzamide
CID 3291691
N-methyl-4-(1-methylsulfanylethyl)benzamide
CID 59428965
[4-(methylcarbamoyl)phenoxy]boronic acid
CID 139843165
ethyl 4-(methylcarbamoyl)benzoate
CID 125143185
[4-(methylcarbamoyl)phenyl] carbamate
CID 20789580

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(4-pentan-3-ylphenoxy)benzamide?
The IUPAC name of N-methyl-4-(4-pentan-3-ylphenoxy)benzamide (CID 142415379) is N-methyl-4-(4-pentan-3-ylphenoxy)benzamide.
What is the SMILES notation for N-methyl-4-(4-pentan-3-ylphenoxy)benzamide?
The canonical SMILES for N-methyl-4-(4-pentan-3-ylphenoxy)benzamide is CCC(CC)c1ccc(Oc2ccc(C(=O)NC)cc2)cc1.
What is the InChIKey of N-methyl-4-(4-pentan-3-ylphenoxy)benzamide?
The InChIKey is ARSABKDYIJSXFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-4-14(5-2)15-6-10-17(11-7-15)22-18-12-8-16(9-13-18)19(21)20-3/h6-14H,4-5H2,1-3H3,(H,20,21).
What are the key properties of N-methyl-4-(4-pentan-3-ylphenoxy)benzamide?
N-methyl-4-(4-pentan-3-ylphenoxy)benzamide has a molecular weight of 297.40 g/mol, XLogP of 4.74, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(4-pentan-3-ylphenoxy)benzamide is sourced from PubChem (CID 142415379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).