2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide

C11H23N3O2 — CID 119642570

IUPAC2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide
SMILESCCC(N)(CC)CNC(=O)CN(C)C(C)=O
InChIInChI=1S/C11H23N3O2/c1-5-11(12,6-2)8-13-10(16)7-14(4)9(3)15/h5-8,12H2,1-4H3,(H,13,16)
InChIKeyDFYDXWWLWAGVNQ-UHFFFAOYSA-N
MW229.32 g/mol
LogP0.10
Rot. Bonds6

About 2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide

2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide (PubChem CID 119642570) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide.

Molecular Properties

Compound Name2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide
PubChem CID119642570
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide
SMILESCCC(N)(CC)CNC(=O)CN(C)C(C)=O
InChIInChI=1S/C11H23N3O2/c1-5-11(12,6-2)8-13-10(16)7-14(4)9(3)15/h5-8,12H2,1-4H3,(H,13,16)
InChIKeyDFYDXWWLWAGVNQ-UHFFFAOYSA-N
XLogP0.10
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide?
The IUPAC name of 2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide (CID 119642570) is 2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide.
What is the SMILES notation for 2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide?
The canonical SMILES for 2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide is CCC(N)(CC)CNC(=O)CN(C)C(C)=O.
What is the InChIKey of 2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide?
The InChIKey is DFYDXWWLWAGVNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-5-11(12,6-2)8-13-10(16)7-14(4)9(3)15/h5-8,12H2,1-4H3,(H,13,16).
What are the key properties of 2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide?
2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide has a molecular weight of 229.32 g/mol, XLogP of 0.10, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(methyl)amino]-N-(2-amino-2-ethylbutyl)acetamide is sourced from PubChem (CID 119642570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).