2,2-dimethyl-N-(2-methylpropanoyl)propanamide

C9H17NO2 — CID 130010818

IUPAC2,2-dimethyl-N-(2-methylpropanoyl)propanamide
SMILESCC(C)C(=O)NC(=O)C(C)(C)C
InChIInChI=1S/C9H17NO2/c1-6(2)7(11)10-8(12)9(3,4)5/h6H,1-5H3,(H,10,11,12)
InChIKeySTXLGWKRYHYVAA-UHFFFAOYSA-N
MW171.24 g/mol
LogP1.33
Rot. Bonds1

About 2,2-dimethyl-N-(2-methylpropanoyl)propanamide

2,2-dimethyl-N-(2-methylpropanoyl)propanamide (PubChem CID 130010818) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is 2,2-dimethyl-N-(2-methylpropanoyl)propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(2-methylpropanoyl)propanamide
PubChem CID130010818
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name2,2-dimethyl-N-(2-methylpropanoyl)propanamide
SMILESCC(C)C(=O)NC(=O)C(C)(C)C
InChIInChI=1S/C9H17NO2/c1-6(2)7(11)10-8(12)9(3,4)5/h6H,1-5H3,(H,10,11,12)
InChIKeySTXLGWKRYHYVAA-UHFFFAOYSA-N
XLogP1.33
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-2-methylpropanamide;ethane
CID 143588307
N-[N-(2,2-dimethylpropanoyl)-N'-[(2S)-1-(methylamino)-1-oxopropan-2-yl]carbamimidoyl]-2,2-dimethylpropanamide
CID 166647779
N-carbamoyl-2-methylpropanamide
CID 541584
2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide
CID 166894562
ethane;2-methyl-2-(2-methylpropanoylamino)propanoic acid
CID 142311120
methyl N-(2-methylpropanoyl)carbamate
CID 59279110
N-(tert-butylcarbamoyl)-2,2-dimethylpropanamide
CID 58200215
2,2-dimethyl-N-prop-1-en-2-ylpropanamide
CID 89153386
N-[6,6-dimethyl-5-(2-methylpropanoylamino)heptyl]-2,2-dimethylpropanamide
CID 155090343
N-(1,3-difluoro-2-methylpropan-2-yl)-2-methylpropanamide
CID 167316537
N-(chlorocarbamoyl)-2,2-dimethylpropanamide
CID 130011017
2-methyl-N-propanoylpropanamide
CID 13378668

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(2-methylpropanoyl)propanamide?
The IUPAC name of 2,2-dimethyl-N-(2-methylpropanoyl)propanamide (CID 130010818) is 2,2-dimethyl-N-(2-methylpropanoyl)propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(2-methylpropanoyl)propanamide?
The canonical SMILES for 2,2-dimethyl-N-(2-methylpropanoyl)propanamide is CC(C)C(=O)NC(=O)C(C)(C)C.
What is the InChIKey of 2,2-dimethyl-N-(2-methylpropanoyl)propanamide?
The InChIKey is STXLGWKRYHYVAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2/c1-6(2)7(11)10-8(12)9(3,4)5/h6H,1-5H3,(H,10,11,12).
What are the key properties of 2,2-dimethyl-N-(2-methylpropanoyl)propanamide?
2,2-dimethyl-N-(2-methylpropanoyl)propanamide has a molecular weight of 171.24 g/mol, XLogP of 1.33, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(2-methylpropanoyl)propanamide is sourced from PubChem (CID 130010818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).