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

C15H18N2O2 — CID 21323634

IUPACN-butyl-N-(4-methyl-1,3-oxazol-2-yl)benzamide
SMILESCCCCN(C(=O)c1ccccc1)c1nc(C)co1
InChIInChI=1S/C15H18N2O2/c1-3-4-10-17(15-16-12(2)11-19-15)14(18)13-8-6-5-7-9-13/h5-9,11H,3-4,10H2,1-2H3
InChIKeyFQBJDAUEIOWVQC-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.43
Rot. Bonds5

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

N-butyl-N-(4-methyl-1,3-oxazol-2-yl)benzamide (PubChem CID 21323634) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-butyl-N-(4-methyl-1,3-oxazol-2-yl)benzamide.

Molecular Properties

Compound NameN-butyl-N-(4-methyl-1,3-oxazol-2-yl)benzamide
PubChem CID21323634
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-butyl-N-(4-methyl-1,3-oxazol-2-yl)benzamide
SMILESCCCCN(C(=O)c1ccccc1)c1nc(C)co1
InChIInChI=1S/C15H18N2O2/c1-3-4-10-17(15-16-12(2)11-19-15)14(18)13-8-6-5-7-9-13/h5-9,11H,3-4,10H2,1-2H3
InChIKeyFQBJDAUEIOWVQC-UHFFFAOYSA-N
XLogP3.43
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-butyl-N-(4-methyl-1,3-oxazol-2-yl)benzamide?
The IUPAC name of N-butyl-N-(4-methyl-1,3-oxazol-2-yl)benzamide (CID 21323634) is N-butyl-N-(4-methyl-1,3-oxazol-2-yl)benzamide.
What is the SMILES notation for N-butyl-N-(4-methyl-1,3-oxazol-2-yl)benzamide?
The canonical SMILES for N-butyl-N-(4-methyl-1,3-oxazol-2-yl)benzamide is CCCCN(C(=O)c1ccccc1)c1nc(C)co1.
What is the InChIKey of N-butyl-N-(4-methyl-1,3-oxazol-2-yl)benzamide?
The InChIKey is FQBJDAUEIOWVQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-3-4-10-17(15-16-12(2)11-19-15)14(18)13-8-6-5-7-9-13/h5-9,11H,3-4,10H2,1-2H3.
What are the key properties of N-butyl-N-(4-methyl-1,3-oxazol-2-yl)benzamide?
N-butyl-N-(4-methyl-1,3-oxazol-2-yl)benzamide has a molecular weight of 258.32 g/mol, XLogP of 3.43, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-(4-methyl-1,3-oxazol-2-yl)benzamide is sourced from PubChem (CID 21323634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).