2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide

C12H26N2O — CID 139298143

IUPAC2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide
SMILESCC(C)C(C)(C)CC(C)(C)NC(=O)CN
InChIInChI=1S/C12H26N2O/c1-9(2)11(3,4)8-12(5,6)14-10(15)7-13/h9H,7-8,13H2,1-6H3,(H,14,15)
InChIKeyVJIYSKPBBZGOEW-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.91
Rot. Bonds5

About 2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide

2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide (PubChem CID 139298143) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide.

Molecular Properties

Compound Name2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide
PubChem CID139298143
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide
SMILESCC(C)C(C)(C)CC(C)(C)NC(=O)CN
InChIInChI=1S/C12H26N2O/c1-9(2)11(3,4)8-12(5,6)14-10(15)7-13/h9H,7-8,13H2,1-6H3,(H,14,15)
InChIKeyVJIYSKPBBZGOEW-UHFFFAOYSA-N
XLogP1.91
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide?
The IUPAC name of 2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide (CID 139298143) is 2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide.
What is the SMILES notation for 2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide?
The canonical SMILES for 2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide is CC(C)C(C)(C)CC(C)(C)NC(=O)CN.
What is the InChIKey of 2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide?
The InChIKey is VJIYSKPBBZGOEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-9(2)11(3,4)8-12(5,6)14-10(15)7-13/h9H,7-8,13H2,1-6H3,(H,14,15).
What are the key properties of 2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide?
2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide has a molecular weight of 214.35 g/mol, XLogP of 1.91, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,4,4,5-tetramethylhexan-2-yl)acetamide is sourced from PubChem (CID 139298143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).