2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide

C12H24N2O2 — CID 155424881

IUPAC2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide
SMILESCCN(CC(=O)N[C@@H](C)C(C)(C)C)C(C)=O
InChIInChI=1S/C12H24N2O2/c1-7-14(10(3)15)8-11(16)13-9(2)12(4,5)6/h9H,7-8H2,1-6H3,(H,13,16)/t9-/m0/s1
InChIKeyUKNKLVVHYDGCAM-VIFPVBQESA-N
MW228.34 g/mol
LogP1.41
Rot. Bonds4

About 2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide

2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide (PubChem CID 155424881) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide.

Molecular Properties

Compound Name2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide
PubChem CID155424881
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide
SMILESCCN(CC(=O)N[C@@H](C)C(C)(C)C)C(C)=O
InChIInChI=1S/C12H24N2O2/c1-7-14(10(3)15)8-11(16)13-9(2)12(4,5)6/h9H,7-8H2,1-6H3,(H,13,16)/t9-/m0/s1
InChIKeyUKNKLVVHYDGCAM-VIFPVBQESA-N
XLogP1.41
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide 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 2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide?
The IUPAC name of 2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide (CID 155424881) is 2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide.
What is the SMILES notation for 2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide?
The canonical SMILES for 2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide is CCN(CC(=O)N[C@@H](C)C(C)(C)C)C(C)=O.
What is the InChIKey of 2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide?
The InChIKey is UKNKLVVHYDGCAM-VIFPVBQESA-N. The full InChI is InChI=1S/C12H24N2O2/c1-7-14(10(3)15)8-11(16)13-9(2)12(4,5)6/h9H,7-8H2,1-6H3,(H,13,16)/t9-/m0/s1.
What are the key properties of 2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide?
2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide has a molecular weight of 228.34 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(ethyl)amino]-N-[(2S)-3,3-dimethylbutan-2-yl]acetamide is sourced from PubChem (CID 155424881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).