2,2-dimethyl-N-(3-methylbutyl)butanamide

C11H23NO — CID 4635244

IUPAC2,2-dimethyl-N-(3-methylbutyl)butanamide
SMILESCCC(C)(C)C(=O)NCCC(C)C
InChIInChI=1S/C11H23NO/c1-6-11(4,5)10(13)12-8-7-9(2)3/h9H,6-8H2,1-5H3,(H,12,13)
InChIKeySZGGKVLJQRSGNG-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.58
Rot. Bonds5

About 2,2-dimethyl-N-(3-methylbutyl)butanamide

2,2-dimethyl-N-(3-methylbutyl)butanamide (PubChem CID 4635244) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 2,2-dimethyl-N-(3-methylbutyl)butanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(3-methylbutyl)butanamide
PubChem CID4635244
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name2,2-dimethyl-N-(3-methylbutyl)butanamide
SMILESCCC(C)(C)C(=O)NCCC(C)C
InChIInChI=1S/C11H23NO/c1-6-11(4,5)10(13)12-8-7-9(2)3/h9H,6-8H2,1-5H3,(H,12,13)
InChIKeySZGGKVLJQRSGNG-UHFFFAOYSA-N
XLogP2.58
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-butylbutanamide
CID 347960
Butanamide, N-(2-methylpropyl)-
CID 346250
N-Isopentylacetamide
CID 98643
N-Ethyl-2,2-diisopropylbutanamide
CID 3016598
n-Butyl-2-methylpropanamide
CID 221968
N-butan-2-yl-3-methylbutanamide
CID 234387
n-(2-Methylbutyl)acetamide
CID 291446
N,3,3-trimethylbutanamide
CID 2795132
Propanamide, N-isobutyl-2,2-dimethyl
CID 528633
N-{2-[(3,3-dimethylbutanoyl)amino]-1-methylethyl}-3,3-dimethylbutanamide
CID 4360846
C3-Amide-C4-NH2
CID 14484861
N-(3-Methylbutyl)propanamide
CID 5152799

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(3-methylbutyl)butanamide?
The IUPAC name of 2,2-dimethyl-N-(3-methylbutyl)butanamide (CID 4635244) is 2,2-dimethyl-N-(3-methylbutyl)butanamide.
What is the SMILES notation for 2,2-dimethyl-N-(3-methylbutyl)butanamide?
The canonical SMILES for 2,2-dimethyl-N-(3-methylbutyl)butanamide is CCC(C)(C)C(=O)NCCC(C)C.
What is the InChIKey of 2,2-dimethyl-N-(3-methylbutyl)butanamide?
The InChIKey is SZGGKVLJQRSGNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-6-11(4,5)10(13)12-8-7-9(2)3/h9H,6-8H2,1-5H3,(H,12,13).
What are the key properties of 2,2-dimethyl-N-(3-methylbutyl)butanamide?
2,2-dimethyl-N-(3-methylbutyl)butanamide has a molecular weight of 185.31 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(3-methylbutyl)butanamide is sourced from PubChem (CID 4635244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).