N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide

C10H12N4OS — CID 17144276

IUPACN-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide
SMILESCc1nc(NC(=O)c2ccnn2C)sc1C
InChIInChI=1S/C10H12N4OS/c1-6-7(2)16-10(12-6)13-9(15)8-4-5-11-14(8)3/h4-5H,1-3H3,(H,12,13,15)
InChIKeyWOVUGVCIIGCONV-UHFFFAOYSA-N
MW236.30 g/mol
LogP1.75
Rot. Bonds2

About N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide

N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide (PubChem CID 17144276) has the molecular formula C10H12N4OS and a molecular weight of 236.30 g/mol. Its IUPAC name is N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide
PubChem CID17144276
Molecular FormulaC10H12N4OS
Molecular Weight236.30 g/mol
Exact Mass236.07
IUPAC NameN-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide
SMILESCc1nc(NC(=O)c2ccnn2C)sc1C
InChIInChI=1S/C10H12N4OS/c1-6-7(2)16-10(12-6)13-9(15)8-4-5-11-14(8)3/h4-5H,1-3H3,(H,12,13,15)
InChIKeyWOVUGVCIIGCONV-UHFFFAOYSA-N
XLogP1.75
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-chloro-1-methyl-N-(1,3-thiazol-2-yl)pyrazole-3-carboxamide
CID 893021
4-chloro-1-ethyl-N-(1,3-thiazol-2-yl)-1H-pyrazole-3-carboxamide
CID 831979
1-ethyl-N-(5-methylthiazol-2-yl)-1H-pyrazole-3-carboxamide
CID 6464339
4-chloro-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)-1H-pyrazole-5-carboxamide
CID 6471003
4-bromo-1-methyl-N-(1,3-thiazol-2-yl)-1H-pyrazole-3-carboxamide
CID 903362
4-bromo-N-(5-bromo-1,3-thiazol-2-yl)-1-methyl-1H-pyrazole-3-carboxamide
CID 1028404
N-(5-chloro-1,3-thiazol-2-yl)-1H-pyrazole-3-carboxamide
CID 71864212
4-bromo-1-ethyl-N-(5-methyl-1,3-thiazol-2-yl)-1H-pyrazole-5-carboxamide
CID 831994
N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-1-methyl-1H-pyrazole-5-carboxamide
CID 6465494
1-ethyl-N-(thiazol-2-yl)-1H-pyrazole-5-carboxamide
CID 649902
4-bromo-1-ethyl-N-(1,3-thiazol-2-yl)-1H-pyrazole-3-carboxamide
CID 831420
4-bromo-2-ethyl-N-(1,3-thiazol-2-yl)pyrazole-3-carboxamide
CID 891968

Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide?
The IUPAC name of N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide (CID 17144276) is N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide.
What is the SMILES notation for N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide?
The canonical SMILES for N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide is Cc1nc(NC(=O)c2ccnn2C)sc1C.
What is the InChIKey of N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide?
The InChIKey is WOVUGVCIIGCONV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4OS/c1-6-7(2)16-10(12-6)13-9(15)8-4-5-11-14(8)3/h4-5H,1-3H3,(H,12,13,15).
What are the key properties of N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide?
N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide has a molecular weight of 236.30 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylpyrazole-3-carboxamide is sourced from PubChem (CID 17144276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).