N-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide

C11H23NO — CID 3016599

IUPACN-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide
SMILESCCNC(=O)C(C)(C(C)C)C(C)C
InChIInChI=1S/C11H23NO/c1-7-12-10(13)11(6,8(2)3)9(4)5/h8-9H,7H2,1-6H3,(H,12,13)
InChIKeyMLGQKMLAQSNRSE-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.44
Rot. Bonds4

About N-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide

N-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide (PubChem CID 3016599) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is N-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide.

Molecular Properties

Compound NameN-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide
PubChem CID3016599
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC NameN-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide
SMILESCCNC(=O)C(C)(C(C)C)C(C)C
InChIInChI=1S/C11H23NO/c1-7-12-10(13)11(6,8(2)3)9(4)5/h8-9H,7H2,1-6H3,(H,12,13)
InChIKeyMLGQKMLAQSNRSE-UHFFFAOYSA-N
XLogP2.44
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide?
The IUPAC name of N-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide (CID 3016599) is N-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide.
What is the SMILES notation for N-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide?
The canonical SMILES for N-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide is CCNC(=O)C(C)(C(C)C)C(C)C.
What is the InChIKey of N-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide?
The InChIKey is MLGQKMLAQSNRSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-7-12-10(13)11(6,8(2)3)9(4)5/h8-9H,7H2,1-6H3,(H,12,13).
What are the key properties of N-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide?
N-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide has a molecular weight of 185.31 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,3-dimethyl-2-propan-2-ylbutanamide is sourced from PubChem (CID 3016599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).