N-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide

C12H20N2O2 — CID 12556895

IUPACN-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide
SMILESCCC(C)N(C(=O)C(C)C)c1nc(C)co1
InChIInChI=1S/C12H20N2O2/c1-6-10(5)14(11(15)8(2)3)12-13-9(4)7-16-12/h7-8,10H,6H2,1-5H3
InChIKeyLASKOYXOOOTXQS-UHFFFAOYSA-N
MW224.30 g/mol
LogP2.77
Rot. Bonds4

About N-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide

N-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide (PubChem CID 12556895) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is N-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide.

Molecular Properties

Compound NameN-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide
PubChem CID12556895
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC NameN-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide
SMILESCCC(C)N(C(=O)C(C)C)c1nc(C)co1
InChIInChI=1S/C12H20N2O2/c1-6-10(5)14(11(15)8(2)3)12-13-9(4)7-16-12/h7-8,10H,6H2,1-5H3
InChIKeyLASKOYXOOOTXQS-UHFFFAOYSA-N
XLogP2.77
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide?
The IUPAC name of N-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide (CID 12556895) is N-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide.
What is the SMILES notation for N-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide?
The canonical SMILES for N-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide is CCC(C)N(C(=O)C(C)C)c1nc(C)co1.
What is the InChIKey of N-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide?
The InChIKey is LASKOYXOOOTXQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-6-10(5)14(11(15)8(2)3)12-13-9(4)7-16-12/h7-8,10H,6H2,1-5H3.
What are the key properties of N-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide?
N-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide has a molecular weight of 224.30 g/mol, XLogP of 2.77, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-methyl-N-(4-methyl-1,3-oxazol-2-yl)propanamide is sourced from PubChem (CID 12556895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).