N,N-diethyl-3,3-dimethylbutanamide

C10H21NO — CID 4630303

IUPACN,N-diethyl-3,3-dimethylbutanamide
SMILESCCN(CC)C(=O)CC(C)(C)C
InChIInChI=1S/C10H21NO/c1-6-11(7-2)9(12)8-10(3,4)5/h6-8H2,1-5H3
InChIKeyKVTAGHWXBWQDCW-UHFFFAOYSA-N
MW171.28 g/mol
LogP2.29
Rot. Bonds3

About N,N-diethyl-3,3-dimethylbutanamide

N,N-diethyl-3,3-dimethylbutanamide (PubChem CID 4630303) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is N,N-diethyl-3,3-dimethylbutanamide.

Molecular Properties

Compound NameN,N-diethyl-3,3-dimethylbutanamide
PubChem CID4630303
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC NameN,N-diethyl-3,3-dimethylbutanamide
SMILESCCN(CC)C(=O)CC(C)(C)C
InChIInChI=1S/C10H21NO/c1-6-11(7-2)9(12)8-10(3,4)5/h6-8H2,1-5H3
InChIKeyKVTAGHWXBWQDCW-UHFFFAOYSA-N
XLogP2.29
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N,N-diethyl-3,3-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,N-Dibutylpropanamide
CID 70909
N,N-Diethylbutanamide
CID 66192
N,N-diethyl-2,2-dimethylpropanamide
CID 4194999
N,N-Diethyl-3-methylbutanamide
CID 68290
N,N-Dibutylbutanamide
CID 243368
N,N-Diisopropyl-1-methylcyclopropanecarboxamide
CID 369219
1-(3-Methylbutyl)pyrrolidine
CID 108876
N,N,3,3-Tetramethylbutanamide
CID 520244
2,2-Dimethyl-1-(pyrrolidin-1-yl)propan-1-one
CID 566664
3,3-Dimethyl-1-(pyrrolidin-1-yl)butan-1-one
CID 574640
3,3-Dimethyl-1-(4-methylpiperazin-1-yl)butan-1-one
CID 4634576
Propanamide, N,N-dibutyl-2-methyl-
CID 253070

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3,3-dimethylbutanamide?
The IUPAC name of N,N-diethyl-3,3-dimethylbutanamide (CID 4630303) is N,N-diethyl-3,3-dimethylbutanamide.
What is the SMILES notation for N,N-diethyl-3,3-dimethylbutanamide?
The canonical SMILES for N,N-diethyl-3,3-dimethylbutanamide is CCN(CC)C(=O)CC(C)(C)C.
What is the InChIKey of N,N-diethyl-3,3-dimethylbutanamide?
The InChIKey is KVTAGHWXBWQDCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-6-11(7-2)9(12)8-10(3,4)5/h6-8H2,1-5H3.
What are the key properties of N,N-diethyl-3,3-dimethylbutanamide?
N,N-diethyl-3,3-dimethylbutanamide has a molecular weight of 171.28 g/mol, XLogP of 2.29, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3,3-dimethylbutanamide is sourced from PubChem (CID 4630303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).