2-[acetyl(methyl)amino]-N-tert-butylpropanamide

C10H20N2O2 — CID 164672279

IUPAC2-[acetyl(methyl)amino]-N-tert-butylpropanamide
SMILESCC(=O)N(C)C(C)C(=O)NC(C)(C)C
InChIInChI=1S/C10H20N2O2/c1-7(12(6)8(2)13)9(14)11-10(3,4)5/h7H,1-6H3,(H,11,14)
InChIKeyYODJBIGPTGBJPX-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.77
Rot. Bonds2

About 2-[acetyl(methyl)amino]-N-tert-butylpropanamide

2-[acetyl(methyl)amino]-N-tert-butylpropanamide (PubChem CID 164672279) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-[acetyl(methyl)amino]-N-tert-butylpropanamide.

Molecular Properties

Compound Name2-[acetyl(methyl)amino]-N-tert-butylpropanamide
PubChem CID164672279
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name2-[acetyl(methyl)amino]-N-tert-butylpropanamide
SMILESCC(=O)N(C)C(C)C(=O)NC(C)(C)C
InChIInChI=1S/C10H20N2O2/c1-7(12(6)8(2)13)9(14)11-10(3,4)5/h7H,1-6H3,(H,11,14)
InChIKeyYODJBIGPTGBJPX-UHFFFAOYSA-N
XLogP0.77
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(methyl)amino]-N-tert-butylpropanamide?
The IUPAC name of 2-[acetyl(methyl)amino]-N-tert-butylpropanamide (CID 164672279) is 2-[acetyl(methyl)amino]-N-tert-butylpropanamide.
What is the SMILES notation for 2-[acetyl(methyl)amino]-N-tert-butylpropanamide?
The canonical SMILES for 2-[acetyl(methyl)amino]-N-tert-butylpropanamide is CC(=O)N(C)C(C)C(=O)NC(C)(C)C.
What is the InChIKey of 2-[acetyl(methyl)amino]-N-tert-butylpropanamide?
The InChIKey is YODJBIGPTGBJPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-7(12(6)8(2)13)9(14)11-10(3,4)5/h7H,1-6H3,(H,11,14).
What are the key properties of 2-[acetyl(methyl)amino]-N-tert-butylpropanamide?
2-[acetyl(methyl)amino]-N-tert-butylpropanamide has a molecular weight of 200.28 g/mol, XLogP of 0.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(methyl)amino]-N-tert-butylpropanamide is sourced from PubChem (CID 164672279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).