2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide

C10H20N2O2 — CID 64866062

IUPAC2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide
SMILESCCC(=O)C(C)N(CC(N)=O)C(C)C
InChIInChI=1S/C10H20N2O2/c1-5-9(13)8(4)12(7(2)3)6-10(11)14/h7-8H,5-6H2,1-4H3,(H2,11,14)
InChIKeyMBMBJXKAMVGDAS-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.55
Rot. Bonds6

About 2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide

2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide (PubChem CID 64866062) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide.

Molecular Properties

Compound Name2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide
PubChem CID64866062
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide
SMILESCCC(=O)C(C)N(CC(N)=O)C(C)C
InChIInChI=1S/C10H20N2O2/c1-5-9(13)8(4)12(7(2)3)6-10(11)14/h7-8H,5-6H2,1-4H3,(H2,11,14)
InChIKeyMBMBJXKAMVGDAS-UHFFFAOYSA-N
XLogP0.55
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide?
The IUPAC name of 2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide (CID 64866062) is 2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide.
What is the SMILES notation for 2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide?
The canonical SMILES for 2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide is CCC(=O)C(C)N(CC(N)=O)C(C)C.
What is the InChIKey of 2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide?
The InChIKey is MBMBJXKAMVGDAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-5-9(13)8(4)12(7(2)3)6-10(11)14/h7-8H,5-6H2,1-4H3,(H2,11,14).
What are the key properties of 2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide?
2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide has a molecular weight of 200.28 g/mol, XLogP of 0.55, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-oxopentan-2-yl(propan-2-yl)amino]acetamide is sourced from PubChem (CID 64866062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).