N-(3,3-dimethylbutyl)butanamide

C10H21NO — CID 115580246

IUPACN-(3,3-dimethylbutyl)butanamide
SMILESCCCC(=O)NCCC(C)(C)C
InChIInChI=1S/C10H21NO/c1-5-6-9(12)11-8-7-10(2,3)4/h5-8H2,1-4H3,(H,11,12)
InChIKeyGNENWMIFWQXWOI-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.34
Rot. Bonds4

About N-(3,3-dimethylbutyl)butanamide

N-(3,3-dimethylbutyl)butanamide (PubChem CID 115580246) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is N-(3,3-dimethylbutyl)butanamide.

Molecular Properties

Compound NameN-(3,3-dimethylbutyl)butanamide
PubChem CID115580246
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC NameN-(3,3-dimethylbutyl)butanamide
SMILESCCCC(=O)NCCC(C)(C)C
InChIInChI=1S/C10H21NO/c1-5-6-9(12)11-8-7-10(2,3)4/h5-8H2,1-4H3,(H,11,12)
InChIKeyGNENWMIFWQXWOI-UHFFFAOYSA-N
XLogP2.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(3,3-dimethylbutyl)butanamide 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

N-(3,3-dimethylbutyl)-4-(methylamino)butanamide
CID 115738133
3-cyano-N-(3,3-dimethylbutyl)propanamide
CID 115173922
N-(3,3-dimethylbutyl)-2-hydroxyacetamide
CID 115140033
N-(3-ethyl-3-hydroxypentyl)-4,4-dimethylpentanamide
CID 130469220
N-butyl-10,10-dimethylundecanamide
CID 19922141
N-[6-(butanoylamino)hexyl]butanamide
CID 5133798
N-[3-[3-(ethylamino)-3-oxopropoxy]-3-methylbutyl]butanamide
CID 146942531
tert-butyl N-[2-(butanoylamino)ethyl]carbamate
CID 88931890
N-(3,3-dimethylbutyl)-11,11-dimethyl-4-oxododecanamide
CID 165080443
N-decyl-7,7-dimethyloctanamide
CID 139961894
N-[3-(butanoylamino)propyl]butanamide;molecular hydrogen
CID 142492676
N-(5,5-dimethylhexyl)-4,4-dimethylpentanamide
CID 59197749

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylbutyl)butanamide?
The IUPAC name of N-(3,3-dimethylbutyl)butanamide (CID 115580246) is N-(3,3-dimethylbutyl)butanamide.
What is the SMILES notation for N-(3,3-dimethylbutyl)butanamide?
The canonical SMILES for N-(3,3-dimethylbutyl)butanamide is CCCC(=O)NCCC(C)(C)C.
What is the InChIKey of N-(3,3-dimethylbutyl)butanamide?
The InChIKey is GNENWMIFWQXWOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-5-6-9(12)11-8-7-10(2,3)4/h5-8H2,1-4H3,(H,11,12).
What are the key properties of N-(3,3-dimethylbutyl)butanamide?
N-(3,3-dimethylbutyl)butanamide has a molecular weight of 171.28 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylbutyl)butanamide is sourced from PubChem (CID 115580246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).