N-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide

C14H24N2O2 — CID 12556880

IUPACN-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide
SMILESCCCCN(C(=O)C(CC)CC)c1nc(C)co1
InChIInChI=1S/C14H24N2O2/c1-5-8-9-16(13(17)12(6-2)7-3)14-15-11(4)10-18-14/h10,12H,5-9H2,1-4H3
InChIKeyOJPLOCHZOYBEIG-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.55
Rot. Bonds7

About N-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide

N-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide (PubChem CID 12556880) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide.

Molecular Properties

Compound NameN-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide
PubChem CID12556880
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC NameN-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide
SMILESCCCCN(C(=O)C(CC)CC)c1nc(C)co1
InChIInChI=1S/C14H24N2O2/c1-5-8-9-16(13(17)12(6-2)7-3)14-15-11(4)10-18-14/h10,12H,5-9H2,1-4H3
InChIKeyOJPLOCHZOYBEIG-UHFFFAOYSA-N
XLogP3.55
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide?
The IUPAC name of N-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide (CID 12556880) is N-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide.
What is the SMILES notation for N-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide?
The canonical SMILES for N-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide is CCCCN(C(=O)C(CC)CC)c1nc(C)co1.
What is the InChIKey of N-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide?
The InChIKey is OJPLOCHZOYBEIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-5-8-9-16(13(17)12(6-2)7-3)14-15-11(4)10-18-14/h10,12H,5-9H2,1-4H3.
What are the key properties of N-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide?
N-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide has a molecular weight of 252.36 g/mol, XLogP of 3.55, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-ethyl-N-(4-methyl-1,3-oxazol-2-yl)butanamide is sourced from PubChem (CID 12556880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).