N,N,3-trimethylbutanamide

C7H15NO — CID 4635762

IUPACN,N,3-trimethylbutanamide
SMILESCC(C)CC(=O)N(C)C
InChIInChI=1S/C7H15NO/c1-6(2)5-7(9)8(3)4/h6H,5H2,1-4H3
InChIKeyLVQDLURAEDSMES-UHFFFAOYSA-N
MW129.20 g/mol
LogP1.12
Rot. Bonds2

About N,N,3-trimethylbutanamide

N,N,3-trimethylbutanamide (PubChem CID 4635762) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is N,N,3-trimethylbutanamide.

Molecular Properties

Compound NameN,N,3-trimethylbutanamide
PubChem CID4635762
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC NameN,N,3-trimethylbutanamide
SMILESCC(C)CC(=O)N(C)C
InChIInChI=1S/C7H15NO/c1-6(2)5-7(9)8(3)4/h6H,5H2,1-4H3
InChIKeyLVQDLURAEDSMES-UHFFFAOYSA-N
XLogP1.12
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N,N,3-trimethylbutanamide 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

Butanamide, N,N-dimethyl-
CID 12973
N,N,2-trimethylpropanamide
CID 243415
N,N-Diethyl-3-methylbutanamide
CID 68290
N,N-Dimethylcyclopropanecarboxamide
CID 140273
N,N,3,3-Tetramethylbutanamide
CID 520244
2-Ethyl-N,N-dimethylbutanamide
CID 3015572
n,n-Dimethylcyclobutanecarboxamide
CID 291606
N,N,2-trimethylbutanamide
CID 4476069
N,N,2,3-tetramethylbutanamide
CID 13583978
2-cyclopropyl-N,N-dimethylacetamide
CID 20757753
Methylbutanoyl 2-methylbutylamine
CID 21263621
N,N,2,2,3-pentamethylbutanamide
CID 53784551

Frequently Asked Questions

What is the IUPAC name of N,N,3-trimethylbutanamide?
The IUPAC name of N,N,3-trimethylbutanamide (CID 4635762) is N,N,3-trimethylbutanamide.
What is the SMILES notation for N,N,3-trimethylbutanamide?
The canonical SMILES for N,N,3-trimethylbutanamide is CC(C)CC(=O)N(C)C.
What is the InChIKey of N,N,3-trimethylbutanamide?
The InChIKey is LVQDLURAEDSMES-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO/c1-6(2)5-7(9)8(3)4/h6H,5H2,1-4H3.
What are the key properties of N,N,3-trimethylbutanamide?
N,N,3-trimethylbutanamide has a molecular weight of 129.20 g/mol, XLogP of 1.12, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3-trimethylbutanamide is sourced from PubChem (CID 4635762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).