2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide

C14H19ClN2O2 — CID 113158729

IUPAC2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide
SMILESCCCCN(CC(=O)Nc1ccc(Cl)cc1)C(C)=O
InChIInChI=1S/C14H19ClN2O2/c1-3-4-9-17(11(2)18)10-14(19)16-13-7-5-12(15)6-8-13/h5-8H,3-4,9-10H2,1-2H3,(H,16,19)
InChIKeyUKVBGELWSYFBDM-UHFFFAOYSA-N
MW282.77 g/mol
LogP2.93
Rot. Bonds6

About 2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide

2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide (PubChem CID 113158729) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is 2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide
PubChem CID113158729
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC Name2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide
SMILESCCCCN(CC(=O)Nc1ccc(Cl)cc1)C(C)=O
InChIInChI=1S/C14H19ClN2O2/c1-3-4-9-17(11(2)18)10-14(19)16-13-7-5-12(15)6-8-13/h5-8H,3-4,9-10H2,1-2H3,(H,16,19)
InChIKeyUKVBGELWSYFBDM-UHFFFAOYSA-N
XLogP2.93
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide 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

2-[acetyl(butyl)amino]-N-[4-[(4-chlorophenyl)methoxy]phenyl]acetamide
CID 113158789
2-[acetyl(butyl)amino]-N-(4-methylphenyl)acetamide
CID 113158704
2-[acetyl(pentyl)amino]-N-(3,4-difluorophenyl)acetamide
CID 113166842
2-[acetyl-[(4-chlorophenyl)methyl]amino]-N-(4-chlorophenyl)acetamide
CID 113162786
2-[acetyl(butyl)amino]-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide
CID 113158787
2-[acetyl(butyl)amino]-N-[2-(4-chlorophenyl)ethyl]acetamide
CID 113158667
2-[acetyl-[2-(2,4-dichlorophenyl)ethyl]amino]-N-(4-chlorophenyl)acetamide
CID 113167057
2-[acetyl-[3-(dimethylamino)propyl]amino]-N-(4-ethylphenyl)acetamide
CID 113160867
2-[acetyl-[2-(cyclohexen-1-yl)ethyl]amino]-N-(4-chlorophenyl)acetamide
CID 113159715
N-(4-chlorophenyl)tridecanamide
CID 4195215
3-[acetyl(butyl)amino]-N-[4-(diethylamino)phenyl]propanamide
CID 113115863
N-[4-[butyl(methyl)amino]phenyl]-2-(4-chlorophenyl)acetamide
CID 112985317

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide?
The IUPAC name of 2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide (CID 113158729) is 2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide.
What is the SMILES notation for 2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide?
The canonical SMILES for 2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide is CCCCN(CC(=O)Nc1ccc(Cl)cc1)C(C)=O.
What is the InChIKey of 2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide?
The InChIKey is UKVBGELWSYFBDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c1-3-4-9-17(11(2)18)10-14(19)16-13-7-5-12(15)6-8-13/h5-8H,3-4,9-10H2,1-2H3,(H,16,19).
What are the key properties of 2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide?
2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide has a molecular weight of 282.77 g/mol, XLogP of 2.93, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(butyl)amino]-N-(4-chlorophenyl)acetamide is sourced from PubChem (CID 113158729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).