N-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide

C15H24N2O — CID 13320882

IUPACN-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide
SMILESCNC(C(=O)Nc1c(C)cccc1C)C(C)(C)C
InChIInChI=1S/C15H24N2O/c1-10-8-7-9-11(2)12(10)17-14(18)13(16-6)15(3,4)5/h7-9,13,16H,1-6H3,(H,17,18)
InChIKeyIFPRCJFFUFEHAK-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.88
Rot. Bonds3

About N-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide

N-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide (PubChem CID 13320882) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide
PubChem CID13320882
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide
SMILESCNC(C(=O)Nc1c(C)cccc1C)C(C)(C)C
InChIInChI=1S/C15H24N2O/c1-10-8-7-9-11(2)12(10)17-14(18)13(16-6)15(3,4)5/h7-9,13,16H,1-6H3,(H,17,18)
InChIKeyIFPRCJFFUFEHAK-UHFFFAOYSA-N
XLogP2.88
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-dimethylphenyl)-2-methylpropanamide;yttrium
CID 158388394
N-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide
CID 110838096
N,N'-bis(2,6-dimethylphenyl)oxamide
CID 3764178
3-amino-N-(2,6-dimethylphenyl)-2,2,3-trimethylbutanamide
CID 65264581
2-amino-N-(2,6-dimethylphenyl)butanamide;hydrochloride
CID 12546861
N-(2,6-dimethylphenyl)-2-methylpentanamide
CID 2890749
(2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide
CID 7044016
[1-(2,6-dimethylanilino)-1-oxobutan-2-yl]-triethylphosphanium;yttrium
CID 158149589
(2S)-N-(2,6-dimethylphenyl)-2-(2,4-dimethylphenyl)sulfanylpropanamide
CID 8734738
N-(2,6-dimethylphenyl)-2-(3-methylphenyl)sulfanylpropanamide
CID 60594153
3-chloro-N-(2,6-dimethylphenyl)-2-methoxypropanamide
CID 57302036
N-(2,6-dimethylphenyl)-2-phenylbutanamide
CID 4117919

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide?
The IUPAC name of N-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide (CID 13320882) is N-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide is CNC(C(=O)Nc1c(C)cccc1C)C(C)(C)C.
What is the InChIKey of N-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide?
The InChIKey is IFPRCJFFUFEHAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-10-8-7-9-11(2)12(10)17-14(18)13(16-6)15(3,4)5/h7-9,13,16H,1-6H3,(H,17,18).
What are the key properties of N-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide?
N-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide has a molecular weight of 248.37 g/mol, XLogP of 2.88, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide is sourced from PubChem (CID 13320882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).