N-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide

C11H8N2O2S — CID 10977329

IUPACN-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide
SMILESO=CNc1ccccc1C(=O)c1nccs1
InChIInChI=1S/C11H8N2O2S/c14-7-13-9-4-2-1-3-8(9)10(15)11-12-5-6-16-11/h1-7H,(H,13,14)
InChIKeyBNYPSOBOWCDICB-UHFFFAOYSA-N
MW232.26 g/mol
LogP1.94
Rot. Bonds4

About N-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide

N-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide (PubChem CID 10977329) has the molecular formula C11H8N2O2S and a molecular weight of 232.26 g/mol. Its IUPAC name is N-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide.

Molecular Properties

Compound NameN-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide
PubChem CID10977329
Molecular FormulaC11H8N2O2S
Molecular Weight232.26 g/mol
Exact Mass232.03
IUPAC NameN-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide
SMILESO=CNc1ccccc1C(=O)c1nccs1
InChIInChI=1S/C11H8N2O2S/c14-7-13-9-4-2-1-3-8(9)10(15)11-12-5-6-16-11/h1-7H,(H,13,14)
InChIKeyBNYPSOBOWCDICB-UHFFFAOYSA-N
XLogP1.94
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide?
The IUPAC name of N-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide (CID 10977329) is N-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide.
What is the SMILES notation for N-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide?
The canonical SMILES for N-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide is O=CNc1ccccc1C(=O)c1nccs1.
What is the InChIKey of N-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide?
The InChIKey is BNYPSOBOWCDICB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2O2S/c14-7-13-9-4-2-1-3-8(9)10(15)11-12-5-6-16-11/h1-7H,(H,13,14).
What are the key properties of N-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide?
N-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide has a molecular weight of 232.26 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,3-thiazole-2-carbonyl)phenyl]formamide is sourced from PubChem (CID 10977329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).