4-(1,3-thiazol-5-ylmethoxy)benzamide

C11H10N2O2S — CID 142600514

IUPAC4-(1,3-thiazol-5-ylmethoxy)benzamide
SMILESNC(=O)c1ccc(OCc2cncs2)cc1
InChIInChI=1S/C11H10N2O2S/c12-11(14)8-1-3-9(4-2-8)15-6-10-5-13-7-16-10/h1-5,7H,6H2,(H2,12,14)
InChIKeyQVXUTHMJYRUHJT-UHFFFAOYSA-N
MW234.28 g/mol
LogP1.82
Rot. Bonds4

About 4-(1,3-thiazol-5-ylmethoxy)benzamide

4-(1,3-thiazol-5-ylmethoxy)benzamide (PubChem CID 142600514) has the molecular formula C11H10N2O2S and a molecular weight of 234.28 g/mol. Its IUPAC name is 4-(1,3-thiazol-5-ylmethoxy)benzamide.

Molecular Properties

Compound Name4-(1,3-thiazol-5-ylmethoxy)benzamide
PubChem CID142600514
Molecular FormulaC11H10N2O2S
Molecular Weight234.28 g/mol
Exact Mass234.05
IUPAC Name4-(1,3-thiazol-5-ylmethoxy)benzamide
SMILESNC(=O)c1ccc(OCc2cncs2)cc1
InChIInChI=1S/C11H10N2O2S/c12-11(14)8-1-3-9(4-2-8)15-6-10-5-13-7-16-10/h1-5,7H,6H2,(H2,12,14)
InChIKeyQVXUTHMJYRUHJT-UHFFFAOYSA-N
XLogP1.82
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(1,3-thiazol-5-ylmethoxy)benzamide?
The IUPAC name of 4-(1,3-thiazol-5-ylmethoxy)benzamide (CID 142600514) is 4-(1,3-thiazol-5-ylmethoxy)benzamide.
What is the SMILES notation for 4-(1,3-thiazol-5-ylmethoxy)benzamide?
The canonical SMILES for 4-(1,3-thiazol-5-ylmethoxy)benzamide is NC(=O)c1ccc(OCc2cncs2)cc1.
What is the InChIKey of 4-(1,3-thiazol-5-ylmethoxy)benzamide?
The InChIKey is QVXUTHMJYRUHJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2S/c12-11(14)8-1-3-9(4-2-8)15-6-10-5-13-7-16-10/h1-5,7H,6H2,(H2,12,14).
What are the key properties of 4-(1,3-thiazol-5-ylmethoxy)benzamide?
4-(1,3-thiazol-5-ylmethoxy)benzamide has a molecular weight of 234.28 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,3-thiazol-5-ylmethoxy)benzamide is sourced from PubChem (CID 142600514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).