N-cyclopropyl-1,2-thiazole-5-carboxamide

C7H8N2OS — CID 110692070

IUPACN-cyclopropyl-1,2-thiazole-5-carboxamide
SMILESO=C(NC1CC1)c1ccns1
InChIInChI=1S/C7H8N2OS/c10-7(9-5-1-2-5)6-3-4-8-11-6/h3-5H,1-2H2,(H,9,10)
InChIKeyIWHZASLSZDHCDX-UHFFFAOYSA-N
MW168.22 g/mol
LogP1.04
Rot. Bonds2

About N-cyclopropyl-1,2-thiazole-5-carboxamide

N-cyclopropyl-1,2-thiazole-5-carboxamide (PubChem CID 110692070) has the molecular formula C7H8N2OS and a molecular weight of 168.22 g/mol. Its IUPAC name is N-cyclopropyl-1,2-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1,2-thiazole-5-carboxamide
PubChem CID110692070
Molecular FormulaC7H8N2OS
Molecular Weight168.22 g/mol
Exact Mass168.04
IUPAC NameN-cyclopropyl-1,2-thiazole-5-carboxamide
SMILESO=C(NC1CC1)c1ccns1
InChIInChI=1S/C7H8N2OS/c10-7(9-5-1-2-5)6-3-4-8-11-6/h3-5H,1-2H2,(H,9,10)
InChIKeyIWHZASLSZDHCDX-UHFFFAOYSA-N
XLogP1.04
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.22
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-1,2-thiazole-5-carboxamide 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-cyclopropyl-1,2-thiazole-5-carboxamide?
The IUPAC name of N-cyclopropyl-1,2-thiazole-5-carboxamide (CID 110692070) is N-cyclopropyl-1,2-thiazole-5-carboxamide.
What is the SMILES notation for N-cyclopropyl-1,2-thiazole-5-carboxamide?
The canonical SMILES for N-cyclopropyl-1,2-thiazole-5-carboxamide is O=C(NC1CC1)c1ccns1.
What is the InChIKey of N-cyclopropyl-1,2-thiazole-5-carboxamide?
The InChIKey is IWHZASLSZDHCDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2OS/c10-7(9-5-1-2-5)6-3-4-8-11-6/h3-5H,1-2H2,(H,9,10).
What are the key properties of N-cyclopropyl-1,2-thiazole-5-carboxamide?
N-cyclopropyl-1,2-thiazole-5-carboxamide has a molecular weight of 168.22 g/mol, XLogP of 1.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1,2-thiazole-5-carboxamide is sourced from PubChem (CID 110692070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).