N-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide

C15H17N3O3 — CID 110743047

IUPACN-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide
SMILESCc1nc(CCNC(=O)CNC(=O)c2ccccc2)co1
InChIInChI=1S/C15H17N3O3/c1-11-18-13(10-21-11)7-8-16-14(19)9-17-15(20)12-5-3-2-4-6-12/h2-6,10H,7-9H2,1H3,(H,16,19)(H,17,20)
InChIKeyLGOFHSOAKCZHFF-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.07
Rot. Bonds6

About N-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide

N-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide (PubChem CID 110743047) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide
PubChem CID110743047
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC NameN-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide
SMILESCc1nc(CCNC(=O)CNC(=O)c2ccccc2)co1
InChIInChI=1S/C15H17N3O3/c1-11-18-13(10-21-11)7-8-16-14(19)9-17-15(20)12-5-3-2-4-6-12/h2-6,10H,7-9H2,1H3,(H,16,19)(H,17,20)
InChIKeyLGOFHSOAKCZHFF-UHFFFAOYSA-N
XLogP1.07
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide 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-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide?
The IUPAC name of N-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide (CID 110743047) is N-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide is Cc1nc(CCNC(=O)CNC(=O)c2ccccc2)co1.
What is the InChIKey of N-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide?
The InChIKey is LGOFHSOAKCZHFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-11-18-13(10-21-11)7-8-16-14(19)9-17-15(20)12-5-3-2-4-6-12/h2-6,10H,7-9H2,1H3,(H,16,19)(H,17,20).
What are the key properties of N-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide?
N-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide has a molecular weight of 287.32 g/mol, XLogP of 1.07, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(2-methyl-1,3-oxazol-4-yl)ethylamino]-2-oxoethyl]benzamide is sourced from PubChem (CID 110743047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).