2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide

C11H11N3O2 — CID 62913787

IUPAC2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide
SMILESCNc1ccccc1C(=O)Nc1cnoc1
InChIInChI=1S/C11H11N3O2/c1-12-10-5-3-2-4-9(10)11(15)14-8-6-13-16-7-8/h2-7,12H,1H3,(H,14,15)
InChIKeyQIBNMYHFDUTBAW-UHFFFAOYSA-N
MW217.23 g/mol
LogP1.97
Rot. Bonds3

About 2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide

2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide (PubChem CID 62913787) has the molecular formula C11H11N3O2 and a molecular weight of 217.23 g/mol. Its IUPAC name is 2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide.

Molecular Properties

Compound Name2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide
PubChem CID62913787
Molecular FormulaC11H11N3O2
Molecular Weight217.23 g/mol
Exact Mass217.09
IUPAC Name2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide
SMILESCNc1ccccc1C(=O)Nc1cnoc1
InChIInChI=1S/C11H11N3O2/c1-12-10-5-3-2-4-9(10)11(15)14-8-6-13-16-7-8/h2-7,12H,1H3,(H,14,15)
InChIKeyQIBNMYHFDUTBAW-UHFFFAOYSA-N
XLogP1.97
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide?
The IUPAC name of 2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide (CID 62913787) is 2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide.
What is the SMILES notation for 2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide?
The canonical SMILES for 2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide is CNc1ccccc1C(=O)Nc1cnoc1.
What is the InChIKey of 2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide?
The InChIKey is QIBNMYHFDUTBAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2/c1-12-10-5-3-2-4-9(10)11(15)14-8-6-13-16-7-8/h2-7,12H,1H3,(H,14,15).
What are the key properties of 2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide?
2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide has a molecular weight of 217.23 g/mol, XLogP of 1.97, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(1,2-oxazol-4-yl)benzamide is sourced from PubChem (CID 62913787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).