N-[5-(dibutylamino)-2-methylphenyl]acetamide

C17H28N2O — CID 148976423

IUPACN-[5-(dibutylamino)-2-methylphenyl]acetamide
SMILESCCCCN(CCCC)c1ccc(C)c(NC(C)=O)c1
InChIInChI=1S/C17H28N2O/c1-5-7-11-19(12-8-6-2)16-10-9-14(3)17(13-16)18-15(4)20/h9-10,13H,5-8,11-12H2,1-4H3,(H,18,20)
InChIKeyPUWWERLJSUGVMY-UHFFFAOYSA-N
MW276.42 g/mol
LogP4.36
Rot. Bonds8

About N-[5-(dibutylamino)-2-methylphenyl]acetamide

N-[5-(dibutylamino)-2-methylphenyl]acetamide (PubChem CID 148976423) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is N-[5-(dibutylamino)-2-methylphenyl]acetamide.

Molecular Properties

Compound NameN-[5-(dibutylamino)-2-methylphenyl]acetamide
PubChem CID148976423
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC NameN-[5-(dibutylamino)-2-methylphenyl]acetamide
SMILESCCCCN(CCCC)c1ccc(C)c(NC(C)=O)c1
InChIInChI=1S/C17H28N2O/c1-5-7-11-19(12-8-6-2)16-10-9-14(3)17(13-16)18-15(4)20/h9-10,13H,5-8,11-12H2,1-4H3,(H,18,20)
InChIKeyPUWWERLJSUGVMY-UHFFFAOYSA-N
XLogP4.36
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[5-(dibutylamino)-2-methylphenyl]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-acetamido-4-(dibutylamino)phenyl]sulfamic acid
CID 23382875
N-[5-(hexylamino)-2-methylphenyl]acetamide
CID 43735857
N'-butyl-N-(2,5-dimethylphenyl)-N'-methyloxamide
CID 47334597
N-[5-(diethylamino)-2-methylphenyl]-2-ethylhexanamide
CID 146667862
N-[5-(diethylamino)-2-methylphenyl]acetamide;5-methoxybenzene-1,3-dicarboxylic acid
CID 158377608
N-[5-(dibutylamino)-2-[(3E)-2-hydroxy-3-(2-hydroxy-4-methylidenecyclohexa-2,5-dien-1-ylidene)-4-oxocyclobuten-1-yl]phenyl]acetamide
CID 136988283
N-[2-[[2-acetamido-4-(diethylamino)phenyl]-[4-(diethylamino)-2-methylphenyl]methyl]-5-(diethylamino)phenyl]acetamide
CID 20537677
N-(2,5-dimethylphenyl)-N',N'-dipropyloxamide
CID 108528705
3-[butyl(methyl)amino]-N-(2,5-dimethylphenyl)propanamide;hydrochloride
CID 2902080
4-(dibutylamino)-2-fluorobenzoic acid
CID 113319789
N-butyl-4-chloro-3-[1-(2-methylanilino)ethenyl]-N-propylaniline
CID 143816280
2-[butyl(2-hydroxyethyl)amino]-N-(5-fluoro-2-methylphenyl)acetamide
CID 60689165

Frequently Asked Questions

What is the IUPAC name of N-[5-(dibutylamino)-2-methylphenyl]acetamide?
The IUPAC name of N-[5-(dibutylamino)-2-methylphenyl]acetamide (CID 148976423) is N-[5-(dibutylamino)-2-methylphenyl]acetamide.
What is the SMILES notation for N-[5-(dibutylamino)-2-methylphenyl]acetamide?
The canonical SMILES for N-[5-(dibutylamino)-2-methylphenyl]acetamide is CCCCN(CCCC)c1ccc(C)c(NC(C)=O)c1.
What is the InChIKey of N-[5-(dibutylamino)-2-methylphenyl]acetamide?
The InChIKey is PUWWERLJSUGVMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-5-7-11-19(12-8-6-2)16-10-9-14(3)17(13-16)18-15(4)20/h9-10,13H,5-8,11-12H2,1-4H3,(H,18,20).
What are the key properties of N-[5-(dibutylamino)-2-methylphenyl]acetamide?
N-[5-(dibutylamino)-2-methylphenyl]acetamide has a molecular weight of 276.42 g/mol, XLogP of 4.36, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(dibutylamino)-2-methylphenyl]acetamide is sourced from PubChem (CID 148976423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).