2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide

C15H26N2O2 — CID 70556996

IUPAC2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide
SMILESCCC(C)C(=O)Nc1noc(CC(C)C)c1C(C)C
InChIInChI=1S/C15H26N2O2/c1-7-11(6)15(18)16-14-13(10(4)5)12(19-17-14)8-9(2)3/h9-11H,7-8H2,1-6H3,(H,16,17,18)
InChIKeyGCBVMBXMHHILLI-UHFFFAOYSA-N
MW266.38 g/mol
LogP3.98
Rot. Bonds6

About 2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide

2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide (PubChem CID 70556996) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide.

Molecular Properties

Compound Name2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide
PubChem CID70556996
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide
SMILESCCC(C)C(=O)Nc1noc(CC(C)C)c1C(C)C
InChIInChI=1S/C15H26N2O2/c1-7-11(6)15(18)16-14-13(10(4)5)12(19-17-14)8-9(2)3/h9-11H,7-8H2,1-6H3,(H,16,17,18)
InChIKeyGCBVMBXMHHILLI-UHFFFAOYSA-N
XLogP3.98
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide?
The IUPAC name of 2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide (CID 70556996) is 2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide.
What is the SMILES notation for 2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide?
The canonical SMILES for 2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide is CCC(C)C(=O)Nc1noc(CC(C)C)c1C(C)C.
What is the InChIKey of 2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide?
The InChIKey is GCBVMBXMHHILLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-7-11(6)15(18)16-14-13(10(4)5)12(19-17-14)8-9(2)3/h9-11H,7-8H2,1-6H3,(H,16,17,18).
What are the key properties of 2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide?
2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide has a molecular weight of 266.38 g/mol, XLogP of 3.98, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[5-(2-methylpropyl)-4-propan-2-yl-1,2-oxazol-3-yl]butanamide is sourced from PubChem (CID 70556996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).