2-methyl-3H-1,3-thiazole-2-carboxamide

C5H8N2OS — CID 152759901

IUPAC2-methyl-3H-1,3-thiazole-2-carboxamide
SMILESCC1(C(N)=O)NC=CS1
InChIInChI=1S/C5H8N2OS/c1-5(4(6)8)7-2-3-9-5/h2-3,7H,1H3,(H2,6,8)
InChIKeyPNCDWHWZZYCPRV-UHFFFAOYSA-N
MW144.20 g/mol
LogP-0.00
Rot. Bonds1

About 2-methyl-3H-1,3-thiazole-2-carboxamide

2-methyl-3H-1,3-thiazole-2-carboxamide (PubChem CID 152759901) has the molecular formula C5H8N2OS and a molecular weight of 144.20 g/mol. Its IUPAC name is 2-methyl-3H-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound Name2-methyl-3H-1,3-thiazole-2-carboxamide
PubChem CID152759901
Molecular FormulaC5H8N2OS
Molecular Weight144.20 g/mol
Exact Mass144.04
IUPAC Name2-methyl-3H-1,3-thiazole-2-carboxamide
SMILESCC1(C(N)=O)NC=CS1
InChIInChI=1S/C5H8N2OS/c1-5(4(6)8)7-2-3-9-5/h2-3,7H,1H3,(H2,6,8)
InChIKeyPNCDWHWZZYCPRV-UHFFFAOYSA-N
XLogP-0.00
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.20
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3H-1,3-thiazole-2-carboxamide?
The IUPAC name of 2-methyl-3H-1,3-thiazole-2-carboxamide (CID 152759901) is 2-methyl-3H-1,3-thiazole-2-carboxamide.
What is the SMILES notation for 2-methyl-3H-1,3-thiazole-2-carboxamide?
The canonical SMILES for 2-methyl-3H-1,3-thiazole-2-carboxamide is CC1(C(N)=O)NC=CS1.
What is the InChIKey of 2-methyl-3H-1,3-thiazole-2-carboxamide?
The InChIKey is PNCDWHWZZYCPRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2OS/c1-5(4(6)8)7-2-3-9-5/h2-3,7H,1H3,(H2,6,8).
What are the key properties of 2-methyl-3H-1,3-thiazole-2-carboxamide?
2-methyl-3H-1,3-thiazole-2-carboxamide has a molecular weight of 144.20 g/mol, XLogP of -0.00, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3H-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 152759901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).