2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide

C14H22N2O — CID 21430532

IUPAC2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide
SMILESCCC(C)NCC(=O)Nc1c(C)cccc1C
InChIInChI=1S/C14H22N2O/c1-5-12(4)15-9-13(17)16-14-10(2)7-6-8-11(14)3/h6-8,12,15H,5,9H2,1-4H3,(H,16,17)
InChIKeyJFSRFVGANPPEOO-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.63
Rot. Bonds5

About 2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide

2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide (PubChem CID 21430532) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide
PubChem CID21430532
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide
SMILESCCC(C)NCC(=O)Nc1c(C)cccc1C
InChIInChI=1S/C14H22N2O/c1-5-12(4)15-9-13(17)16-14-10(2)7-6-8-11(14)3/h6-8,12,15H,5,9H2,1-4H3,(H,16,17)
InChIKeyJFSRFVGANPPEOO-UHFFFAOYSA-N
XLogP2.63
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)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-[[(2S)-butan-2-yl]amino]-N-(2-chloro-6-methylphenyl)acetamide
CID 124514697
2-[[2-(2,6-dimethylanilino)-2-oxoethyl]amino]propanoic acid
CID 43467206
2-[[2-(2,6-dimethylanilino)-2-oxoethyl]amino]-3-methylbutanoic acid
CID 43468395
2-(butan-2-ylamino)-N-(3-hydroxyphenyl)acetamide
CID 61166125
2-(butan-2-ylamino)-N-(2,6-dichloro-3-methylphenyl)acetamide
CID 60646972
2-[[(2S)-butan-2-yl]amino]-N-(3-methylphenyl)acetamide
CID 2386923
N-(2,6-dimethylphenyl)-2-[[(2S)-1-thiophen-3-ylpropan-2-yl]amino]acetamide
CID 97229162
2-(butan-2-ylamino)-N-(2,4,6-trichlorophenyl)acetamide
CID 60646938
(2S,3S)-2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-3-methylpentanoic acid
CID 122099909
N-(2,6-dimethylphenyl)-3-(propan-2-ylamino)propanamide
CID 54924858
2-[[(1S)-1-[4-[(2R)-butan-2-yl]phenyl]-2-methylpropyl]amino]-N-[2-(2,6-dimethylanilino)-2-oxoethyl]acetamide
CID 8834390
2-(butan-2-ylamino)-N-pyridin-2-ylacetamide
CID 60852283

Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide?
The IUPAC name of 2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide (CID 21430532) is 2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide?
The canonical SMILES for 2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide is CCC(C)NCC(=O)Nc1c(C)cccc1C.
What is the InChIKey of 2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide?
The InChIKey is JFSRFVGANPPEOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-5-12(4)15-9-13(17)16-14-10(2)7-6-8-11(14)3/h6-8,12,15H,5,9H2,1-4H3,(H,16,17).
What are the key properties of 2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide?
2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide has a molecular weight of 234.34 g/mol, XLogP of 2.63, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide is sourced from PubChem (CID 21430532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).