2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide

C10H20N2O2 — CID 90167294

IUPAC2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide
SMILESCC(C)C(=O)CNC(=O)C(N)C(C)C
InChIInChI=1S/C10H20N2O2/c1-6(2)8(13)5-12-10(14)9(11)7(3)4/h6-7,9H,5,11H2,1-4H3,(H,12,14)
InChIKeyHWGSNBNIXMPMLQ-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.31
Rot. Bonds5

About 2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide

2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide (PubChem CID 90167294) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide.

Molecular Properties

Compound Name2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide
PubChem CID90167294
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide
SMILESCC(C)C(=O)CNC(=O)C(N)C(C)C
InChIInChI=1S/C10H20N2O2/c1-6(2)8(13)5-12-10(14)9(11)7(3)4/h6-7,9H,5,11H2,1-4H3,(H,12,14)
InChIKeyHWGSNBNIXMPMLQ-UHFFFAOYSA-N
XLogP0.31
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide?
The IUPAC name of 2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide (CID 90167294) is 2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide.
What is the SMILES notation for 2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide?
The canonical SMILES for 2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide is CC(C)C(=O)CNC(=O)C(N)C(C)C.
What is the InChIKey of 2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide?
The InChIKey is HWGSNBNIXMPMLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-6(2)8(13)5-12-10(14)9(11)7(3)4/h6-7,9H,5,11H2,1-4H3,(H,12,14).
What are the key properties of 2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide?
2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide has a molecular weight of 200.28 g/mol, XLogP of 0.31, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methyl-N-(3-methyl-2-oxobutyl)butanamide is sourced from PubChem (CID 90167294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).