5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide

C18H20N6OS — CID 91091619

IUPAC5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide
SMILESCc1cc(NC(=O)c2nc(C)sc2Nc2cc(C3CC3)nn2C)ccn1
InChIInChI=1S/C18H20N6OS/c1-10-8-13(6-7-19-10)21-17(25)16-18(26-11(2)20-16)22-15-9-14(12-4-5-12)23-24(15)3/h6-9,12,22H,4-5H2,1-3H3,(H,19,21,25)
InChIKeyJBIWITHRIOOFMG-UHFFFAOYSA-N
MW368.47 g/mol
LogP3.76
Rot. Bonds5

About 5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide

5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide (PubChem CID 91091619) has the molecular formula C18H20N6OS and a molecular weight of 368.47 g/mol. Its IUPAC name is 5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide
PubChem CID91091619
Molecular FormulaC18H20N6OS
Molecular Weight368.47 g/mol
Exact Mass368.14
IUPAC Name5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide
SMILESCc1cc(NC(=O)c2nc(C)sc2Nc2cc(C3CC3)nn2C)ccn1
InChIInChI=1S/C18H20N6OS/c1-10-8-13(6-7-19-10)21-17(25)16-18(26-11(2)20-16)22-15-9-14(12-4-5-12)23-24(15)3/h6-9,12,22H,4-5H2,1-3H3,(H,19,21,25)
InChIKeyJBIWITHRIOOFMG-UHFFFAOYSA-N
XLogP3.76
TPSA84.73 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.47
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-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

(S)-5-amino-N-(5-(4-aminoazepan-1-yl)-1-methyl-1H-pyrazol-4-yl)-2-(2,6-difluorophenyl)thiazole-4-carboxamide
CID 53482602
Gdc-0339
CID 73603034
(S)-5-amino-N-(5-(3-aminopiperidin-1-yl)-1-methyl-1H-pyrazol-4-yl)-2-(2-fluorophenyl)thiazole-4-carboxamide
CID 53482332
5-amino-N-[5-(1,4-diazepan-1-yl)-1-methylpyrazol-4-yl]-2-(2,6-difluorophenyl)-1,3-thiazole-4-carboxamide
CID 53482785
5-amino-N-[5-(4-amino-3-fluoroazepan-1-yl)-1-methylpyrazol-4-yl]-2-(2,6-difluorophenyl)-1,3-thiazole-4-carboxamide
CID 58464982
CID 71539661
CID 71539661
5-amino-N-[5-[(5R)-5-amino-3,3-difluoro-5-methylazepan-1-yl]-1-methylpyrazol-4-yl]-2-(2,6-difluorophenyl)-1,3-thiazole-4-carboxamide
CID 74983298
5-amino-N-(5-(5-amino-3-fluoroazepan-1-yl)-1-methyl-1H-pyrazol-4-yl)-2-(2,6-difluorophenyl)thiazole-4-carboxamide
CID 78103829
5-amino-2-(2,6-difluorophenyl)-N-(1-methyl-5-(piperidin-4-ylmethylamino)-1H-pyrazol-4-yl)thiazole-4-carboxamide
CID 53482278
5-amino-2-(2,6-difluorophenyl)-N-[1-methyl-5-[(4S)-4-(2,2,2-trifluoroethylamino)azepan-1-yl]pyrazol-4-yl]-1,3-thiazole-4-carboxamide
CID 155520986
5-amino-N-[5-[(5R)-5-amino-4,4-difluoroazepan-1-yl]-1-methylpyrazol-4-yl]-2-(2,6-difluorophenyl)-1,3-thiazole-4-carboxamide
CID 155521436
5-amino-N-[5-[(4S)-4-(2,2-difluoroethylamino)azepan-1-yl]-1-methylpyrazol-4-yl]-2-(2,6-difluorophenyl)-1,3-thiazole-4-carboxamide
CID 155525211

Frequently Asked Questions

What is the IUPAC name of 5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide (CID 91091619) is 5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide is Cc1cc(NC(=O)c2nc(C)sc2Nc2cc(C3CC3)nn2C)ccn1.
What is the InChIKey of 5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide?
The InChIKey is JBIWITHRIOOFMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6OS/c1-10-8-13(6-7-19-10)21-17(25)16-18(26-11(2)20-16)22-15-9-14(12-4-5-12)23-24(15)3/h6-9,12,22H,4-5H2,1-3H3,(H,19,21,25).
What are the key properties of 5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide?
5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide has a molecular weight of 368.47 g/mol, XLogP of 3.76, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-cyclopropyl-1-methylpyrazol-5-yl)amino]-2-methyl-N-(2-methyl-4-pyridinyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 91091619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).