N-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide

C15H24N2O — CID 110838096

IUPACN-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide
SMILESCNC(CC(C)C)C(=O)Nc1c(C)cccc1C
InChIInChI=1S/C15H24N2O/c1-10(2)9-13(16-5)15(18)17-14-11(3)7-6-8-12(14)4/h6-8,10,13,16H,9H2,1-5H3,(H,17,18)
InChIKeyIGRATEWUSVDCHW-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.88
Rot. Bonds5

About N-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide

N-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide (PubChem CID 110838096) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide
PubChem CID110838096
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide
SMILESCNC(CC(C)C)C(=O)Nc1c(C)cccc1C
InChIInChI=1S/C15H24N2O/c1-10(2)9-13(16-5)15(18)17-14-11(3)7-6-8-12(14)4/h6-8,10,13,16H,9H2,1-5H3,(H,17,18)
InChIKeyIGRATEWUSVDCHW-UHFFFAOYSA-N
XLogP2.88
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
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

[3,5-dimethyl-4-[[4-methyl-2-(methylamino)pentanoyl]amino]phenyl]methyl acetate
CID 59656956
N-(2,6-dimethylphenyl)-2-methylpropanamide;yttrium
CID 158388394
N-(2,6-dimethylphenyl)-2-methylpentanamide
CID 2890749
N-(2,6-dimethylphenyl)-2-(pentan-3-ylamino)butanamide
CID 67216874
N-(2,6-dimethylphenyl)-3,3-dimethyl-2-(methylamino)butanamide
CID 13320882
N-[(2R)-1-[[2-(2,6-dimethylanilino)-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]-2-methylbenzamide
CID 26002664
4-amino-N-(2,6-dimethylphenyl)-2-methyl-4-sulfanylidenebutanamide
CID 82119337
(2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide
CID 7044016
2-amino-N-(2,6-dimethylphenyl)butanamide;hydrochloride
CID 12546861
ethane;N-(4-ethylphenyl)-4-methyl-2-(methylamino)pentanamide;molecular hydrogen
CID 142243925
N,N'-bis(2,6-dimethylphenyl)oxamide
CID 3764178
(2S)-2-[(2,3-dimethylphenyl)carbamoylamino]-4-methylpentanoate
CID 6956422

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide?
The IUPAC name of N-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide (CID 110838096) is N-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide is CNC(CC(C)C)C(=O)Nc1c(C)cccc1C.
What is the InChIKey of N-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide?
The InChIKey is IGRATEWUSVDCHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-10(2)9-13(16-5)15(18)17-14-11(3)7-6-8-12(14)4/h6-8,10,13,16H,9H2,1-5H3,(H,17,18).
What are the key properties of N-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide?
N-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide has a molecular weight of 248.37 g/mol, XLogP of 2.88, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide is sourced from PubChem (CID 110838096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).