5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide

C10H12N4OS — CID 49411134

IUPAC5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide
SMILESCc1cc(C(=O)NCCc2nccs2)n[nH]1
InChIInChI=1S/C10H12N4OS/c1-7-6-8(14-13-7)10(15)12-3-2-9-11-4-5-16-9/h4-6H,2-3H2,1H3,(H,12,15)(H,13,14)
InChIKeyJGLGHEGTLUMKFL-UHFFFAOYSA-N
MW236.30 g/mol
LogP1.15
Rot. Bonds4

About 5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide

5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide (PubChem CID 49411134) has the molecular formula C10H12N4OS and a molecular weight of 236.30 g/mol. Its IUPAC name is 5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide
PubChem CID49411134
Molecular FormulaC10H12N4OS
Molecular Weight236.30 g/mol
Exact Mass236.07
IUPAC Name5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide
SMILESCc1cc(C(=O)NCCc2nccs2)n[nH]1
InChIInChI=1S/C10H12N4OS/c1-7-6-8(14-13-7)10(15)12-3-2-9-11-4-5-16-9/h4-6H,2-3H2,1H3,(H,12,15)(H,13,14)
InChIKeyJGLGHEGTLUMKFL-UHFFFAOYSA-N
XLogP1.15
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1H-pyrazole-3-carboxamide
CID 45830775
1-({5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}carbonyl)-2-(1,3-thiazol-2-yl)piperidine
CID 45176959
2-[1-({5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-1H-pyrazol-3-yl}carbonyl)-2-pyrrolidinyl]-1,3-thiazole
CID 45188891
N-(2-(thiazol-2-yl)ethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide
CID 71705685
5-cyclopropyl-N-[1-(1,3-thiazol-2-yl)cyclopentyl]-1H-pyrazole-3-carboxamide
CID 71875704
(5-methyl-1H-pyrazol-3-yl)-[2-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone
CID 72145418
Pyrrolidin-1-yl-[6-(1,3-thiazol-2-ylmethyl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-3-yl]methanone
CID 97381235
N,N-dimethyl-6-(1,3-thiazol-2-ylmethyl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridine-3-carboxamide
CID 97388981
(4-Methylpiperazin-1-yl)-[6-(1,3-thiazol-2-ylmethyl)-1,4,5,7-tetrahydropyrazolo[5,4-c]pyridin-3-yl]methanone
CID 97389001
N-(1-hydroxy-2-methylpropan-2-yl)-1-pentyl-5-(1,3-thiazol-2-yl)pyrazole-3-carboxamide
CID 178296726
N-[(4-ethenyl-1,3-thiazol-2-yl)methyl]-1H-pyrazole-5-carboxamide
CID 177700548
N-[(4-cyclopropyl-1,3-thiazol-2-yl)methyl]-1H-pyrazole-5-carboxamide
CID 177700549

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide (CID 49411134) is 5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide is Cc1cc(C(=O)NCCc2nccs2)n[nH]1.
What is the InChIKey of 5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide?
The InChIKey is JGLGHEGTLUMKFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4OS/c1-7-6-8(14-13-7)10(15)12-3-2-9-11-4-5-16-9/h4-6H,2-3H2,1H3,(H,12,15)(H,13,14).
What are the key properties of 5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide?
5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide has a molecular weight of 236.30 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 49411134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).