N-(3-chloro-4-methoxyphenyl)butanamide

C11H14ClNO2 — CID 875969

IUPACN-(3-chloro-4-methoxyphenyl)butanamide
SMILESCCCC(=O)Nc1ccc(OC)c(Cl)c1
InChIInChI=1S/C11H14ClNO2/c1-3-4-11(14)13-8-5-6-10(15-2)9(12)7-8/h5-7H,3-4H2,1-2H3,(H,13,14)
InChIKeyYARUWRVNNXPHIJ-UHFFFAOYSA-N
MW227.69 g/mol
LogP3.09
Rot. Bonds4

About N-(3-chloro-4-methoxyphenyl)butanamide

N-(3-chloro-4-methoxyphenyl)butanamide (PubChem CID 875969) has the molecular formula C11H14ClNO2 and a molecular weight of 227.69 g/mol. Its IUPAC name is N-(3-chloro-4-methoxyphenyl)butanamide.

Molecular Properties

Compound NameN-(3-chloro-4-methoxyphenyl)butanamide
PubChem CID875969
Molecular FormulaC11H14ClNO2
Molecular Weight227.69 g/mol
Exact Mass227.07
IUPAC NameN-(3-chloro-4-methoxyphenyl)butanamide
SMILESCCCC(=O)Nc1ccc(OC)c(Cl)c1
InChIInChI=1S/C11H14ClNO2/c1-3-4-11(14)13-8-5-6-10(15-2)9(12)7-8/h5-7H,3-4H2,1-2H3,(H,13,14)
InChIKeyYARUWRVNNXPHIJ-UHFFFAOYSA-N
XLogP3.09
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.69
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(3-chloro-4-methoxyphenyl)butanamide 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

N,N'-bis(3-chloro-4-methoxyphenyl)hexanediamide
CID 4945268
N-(3-chloro-4-methoxyphenyl)-3-[methylsulfonyl(propyl)amino]propanamide
CID 113135971
3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chloro-4-methoxyphenyl)propanamide
CID 109039005
3-(2-chloroanilino)-N-(3-chloro-4-methoxyphenyl)propanamide
CID 109037877
N-(3-chloro-4-methoxyphenyl)-3-(3,4-dimethylanilino)propanamide
CID 109035530
N-(3-chloro-4-methoxyphenyl)-3-(3-chloro-4-methylanilino)propanamide
CID 109038668
N-(3-chloro-4-methoxyphenyl)-3-(2,4-dimethoxyanilino)propanamide
CID 109038965
N-(3-chloro-4-methoxyphenyl)-2-(propylsulfonylamino)acetamide
CID 112998367
N-(3-chloro-4-methoxyphenyl)-3-(dimethylsulfamoyl)propanamide
CID 110343385
N-(3-chloro-4-methoxyphenyl)-2-cyanoacetamide
CID 3854691
N-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide
CID 7695455
2-[butyl(methyl)amino]-N-(3-chloro-4-methoxyphenyl)acetamide
CID 31477725

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methoxyphenyl)butanamide?
The IUPAC name of N-(3-chloro-4-methoxyphenyl)butanamide (CID 875969) is N-(3-chloro-4-methoxyphenyl)butanamide.
What is the SMILES notation for N-(3-chloro-4-methoxyphenyl)butanamide?
The canonical SMILES for N-(3-chloro-4-methoxyphenyl)butanamide is CCCC(=O)Nc1ccc(OC)c(Cl)c1.
What is the InChIKey of N-(3-chloro-4-methoxyphenyl)butanamide?
The InChIKey is YARUWRVNNXPHIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO2/c1-3-4-11(14)13-8-5-6-10(15-2)9(12)7-8/h5-7H,3-4H2,1-2H3,(H,13,14).
What are the key properties of N-(3-chloro-4-methoxyphenyl)butanamide?
N-(3-chloro-4-methoxyphenyl)butanamide has a molecular weight of 227.69 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methoxyphenyl)butanamide is sourced from PubChem (CID 875969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).