N-(2,6-dimethylphenyl)-2-methylpentanamide

C14H21NO — CID 2890749

IUPACN-(2,6-dimethylphenyl)-2-methylpentanamide
SMILESCCCC(C)C(=O)Nc1c(C)cccc1C
InChIInChI=1S/C14H21NO/c1-5-7-12(4)14(16)15-13-10(2)8-6-9-11(13)3/h6,8-9,12H,5,7H2,1-4H3,(H,15,16)
InChIKeyRAFFEBDPHSRLMS-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.68
Rot. Bonds4

About N-(2,6-dimethylphenyl)-2-methylpentanamide

N-(2,6-dimethylphenyl)-2-methylpentanamide (PubChem CID 2890749) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-2-methylpentanamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-2-methylpentanamide
PubChem CID2890749
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC NameN-(2,6-dimethylphenyl)-2-methylpentanamide
SMILESCCCC(C)C(=O)Nc1c(C)cccc1C
InChIInChI=1S/C14H21NO/c1-5-7-12(4)14(16)15-13-10(2)8-6-9-11(13)3/h6,8-9,12H,5,7H2,1-4H3,(H,15,16)
InChIKeyRAFFEBDPHSRLMS-UHFFFAOYSA-N
XLogP3.68
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,6-diethylphenyl)-2-methylpentanamide
CID 2952555
[1-(2,6-dimethylanilino)-1-oxopentan-2-yl]-dimethyl-sulfidophosphanium;yttrium
CID 156737684
5-(2-ethyl-6-methylanilino)-4-methyl-5-oxopentanoic acid
CID 112517138
2-(diethylamino)-N-(2,6-dimethylphenyl)pentanamide
CID 3048765
N-(2-cyano-3-methylphenyl)-2-methylpentanamide
CID 113241611
N-(2,6-dimethylphenyl)-2-methylpropanamide;yttrium
CID 158388394
4-amino-N-(2,6-dimethylphenyl)-2-methyl-4-sulfanylidenebutanamide
CID 82119337
2-methyl-N-phenylpentanamide
CID 4627801
(2S)-2-(diethylamino)-N-(2,6-dimethylphenyl)propanamide
CID 7044016
3-chloro-2-methyl-N-(2-methyl-6-propan-2-ylphenyl)propanamide
CID 62727710
N-(2,6-dimethylphenyl)-2-(pentan-3-ylamino)butanamide
CID 67216874
N-(2,6-dimethylphenyl)-4-methyl-2-(methylamino)pentanamide
CID 110838096

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-2-methylpentanamide?
The IUPAC name of N-(2,6-dimethylphenyl)-2-methylpentanamide (CID 2890749) is N-(2,6-dimethylphenyl)-2-methylpentanamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-2-methylpentanamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-2-methylpentanamide is CCCC(C)C(=O)Nc1c(C)cccc1C.
What is the InChIKey of N-(2,6-dimethylphenyl)-2-methylpentanamide?
The InChIKey is RAFFEBDPHSRLMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-5-7-12(4)14(16)15-13-10(2)8-6-9-11(13)3/h6,8-9,12H,5,7H2,1-4H3,(H,15,16).
What are the key properties of N-(2,6-dimethylphenyl)-2-methylpentanamide?
N-(2,6-dimethylphenyl)-2-methylpentanamide has a molecular weight of 219.33 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-2-methylpentanamide is sourced from PubChem (CID 2890749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).