N-ethyl-N,2-dimethylbutanamide

C8H17NO — CID 89343843

IUPACN-ethyl-N,2-dimethylbutanamide
SMILESCCC(C)C(=O)N(C)CC
InChIInChI=1S/C8H17NO/c1-5-7(3)8(10)9(4)6-2/h7H,5-6H2,1-4H3
InChIKeyGVPGICNRJDVIEC-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.51
Rot. Bonds3

About N-ethyl-N,2-dimethylbutanamide

N-ethyl-N,2-dimethylbutanamide (PubChem CID 89343843) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is N-ethyl-N,2-dimethylbutanamide.

Molecular Properties

Compound NameN-ethyl-N,2-dimethylbutanamide
PubChem CID89343843
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC NameN-ethyl-N,2-dimethylbutanamide
SMILESCCC(C)C(=O)N(C)CC
InChIInChI=1S/C8H17NO/c1-5-7(3)8(10)9(4)6-2/h7H,5-6H2,1-4H3
InChIKeyGVPGICNRJDVIEC-UHFFFAOYSA-N
XLogP1.51
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-ethyl-N,2-dimethylbutanamide 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,2-dimethyl-N-propylbutanamide
CID 89368936
N-(2-bromoethyl)-N,2-dimethylbutanamide
CID 80658346
(2R)-N-hydroxy-N,2-dimethylbutanamide
CID 171076136
(2S)-N,N-diethyl-2-methylbutanamide
CID 158106259
N-ethyl-N,2-dimethyl-3-oxobutanamide
CID 18683063
N-acetyl-N,2-dimethylbutanamide;ethane
CID 177191863
N-ethyl-2-(hydroxymethyl)-N-methylbutanamide
CID 115186409
N-(3-amino-4-methylpentyl)-N,2-dimethylbutanamide;hydrochloride
CID 119657234
N-(3-amino-3-hydroxyimino-2-methylpropyl)-N,2-dimethylbutanamide
CID 76910787
(2S,3S)-N-ethyl-N,3-dimethyl-2-(methylamino)pentanamide
CID 89069924
[ethyl(2-methylbutanoyl)amino]phosphonic acid
CID 87900288
N-ethyl-N-methyl-2-(propan-2-ylamino)propanamide
CID 103107904

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,2-dimethylbutanamide?
The IUPAC name of N-ethyl-N,2-dimethylbutanamide (CID 89343843) is N-ethyl-N,2-dimethylbutanamide.
What is the SMILES notation for N-ethyl-N,2-dimethylbutanamide?
The canonical SMILES for N-ethyl-N,2-dimethylbutanamide is CCC(C)C(=O)N(C)CC.
What is the InChIKey of N-ethyl-N,2-dimethylbutanamide?
The InChIKey is GVPGICNRJDVIEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-5-7(3)8(10)9(4)6-2/h7H,5-6H2,1-4H3.
What are the key properties of N-ethyl-N,2-dimethylbutanamide?
N-ethyl-N,2-dimethylbutanamide has a molecular weight of 143.23 g/mol, XLogP of 1.51, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,2-dimethylbutanamide is sourced from PubChem (CID 89343843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).