2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide

C10H13N5OS — CID 62794429

IUPAC2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide
SMILESCc1nc(N)sc1C(=O)Nc1c(C)n[nH]c1C
InChIInChI=1S/C10H13N5OS/c1-4-7(5(2)15-14-4)13-9(16)8-6(3)12-10(11)17-8/h1-3H3,(H2,11,12)(H,13,16)(H,14,15)
InChIKeyLCGYUVKJWFXKEL-UHFFFAOYSA-N
MW251.31 g/mol
LogP1.63
Rot. Bonds2

About 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide

2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide (PubChem CID 62794429) has the molecular formula C10H13N5OS and a molecular weight of 251.31 g/mol. Its IUPAC name is 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide
PubChem CID62794429
Molecular FormulaC10H13N5OS
Molecular Weight251.31 g/mol
Exact Mass251.08
IUPAC Name2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide
SMILESCc1nc(N)sc1C(=O)Nc1c(C)n[nH]c1C
InChIInChI=1S/C10H13N5OS/c1-4-7(5(2)15-14-4)13-9(16)8-6(3)12-10(11)17-8/h1-3H3,(H2,11,12)(H,13,16)(H,14,15)
InChIKeyLCGYUVKJWFXKEL-UHFFFAOYSA-N
XLogP1.63
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.31
LogP ≤ 51.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-Acetylamino-thiazole-4-carboxylic acid (3,5-dimethyl-1H-pyrazol-4-yl)-amide
CID 652326
2,4-dimethyl-N-(1,3,5-trimethylpyrazol-4-yl)-1,3-thiazole-5-carboxamide
CID 24659019
2-amino-N-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propyl]-4-methyl-1,3-thiazole-5-carboxamide
CID 29183967
2-[(2-amino-4-methyl-1,3-thiazol-5-yl)sulfanyl]-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
CID 43250632
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 43546689
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[2-(methanesulfonamido)-1,3-thiazol-4-yl]acetamide
CID 43546789
N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide
CID 43546931
N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 54954113
N-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 54955820
4-amino-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-5-ethyl-1H-pyrazole-3-carboxamide
CID 55033859
4-amino-N-(4,5-dimethyl-1,3-thiazol-2-yl)-5-propyl-1H-pyrazole-3-carboxamide
CID 55034071
4-amino-5-methyl-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1H-pyrazole-3-carboxamide
CID 55034286

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide (CID 62794429) is 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide is Cc1nc(N)sc1C(=O)Nc1c(C)n[nH]c1C.
What is the InChIKey of 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide?
The InChIKey is LCGYUVKJWFXKEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5OS/c1-4-7(5(2)15-14-4)13-9(16)8-6(3)12-10(11)17-8/h1-3H3,(H2,11,12)(H,13,16)(H,14,15).
What are the key properties of 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide?
2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide has a molecular weight of 251.31 g/mol, XLogP of 1.63, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 62794429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).