5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C15H13N7OS — CID 167960553

IUPAC5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1ccn2ncc(C(=O)Nc3nc(-c4nccn4C)cs3)c2n1
InChIInChI=1S/C15H13N7OS/c1-9-3-5-22-12(18-9)10(7-17-22)14(23)20-15-19-11(8-24-15)13-16-4-6-21(13)2/h3-8H,1-2H3,(H,19,20,23)
InChIKeyNAVBIJVTPBRQGA-UHFFFAOYSA-N
MW339.38 g/mol
LogP2.15
Rot. Bonds3

About 5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 167960553) has the molecular formula C15H13N7OS and a molecular weight of 339.38 g/mol. Its IUPAC name is 5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID167960553
Molecular FormulaC15H13N7OS
Molecular Weight339.38 g/mol
Exact Mass339.09
IUPAC Name5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1ccn2ncc(C(=O)Nc3nc(-c4nccn4C)cs3)c2n1
InChIInChI=1S/C15H13N7OS/c1-9-3-5-22-12(18-9)10(7-17-22)14(23)20-15-19-11(8-24-15)13-16-4-6-21(13)2/h3-8H,1-2H3,(H,19,20,23)
InChIKeyNAVBIJVTPBRQGA-UHFFFAOYSA-N
XLogP2.15
TPSA90.00 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.38
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

2,4-dimethyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]-1,3-thiazole-5-carboxamide
CID 167936632
N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
CID 167797101
5-methyl-N-[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 56787176
5-methyl-N-[(2S,3S)-2-(2-methylpyrazol-3-yl)oxolan-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 128986488
N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide
CID 126771267
5-methyl-N-[(1R,2R)-2-phenylcyclobutyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 97073098
5-methyl-N-[(1-methylpyrrol-3-yl)methyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 136512225
N-(1,3-benzodioxol-5-yl)-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 136523125
2,2-dimethyl-3-[(5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]propanoic acid
CID 119249566
N-[2-(dimethylamino)quinolin-6-yl]-5-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 122133688
1-[(5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 119132499
2-methoxy-N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]pyridine-3-carboxamide
CID 134003036

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 167960553) is 5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1ccn2ncc(C(=O)Nc3nc(-c4nccn4C)cs3)c2n1.
What is the InChIKey of 5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is NAVBIJVTPBRQGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N7OS/c1-9-3-5-22-12(18-9)10(7-17-22)14(23)20-15-19-11(8-24-15)13-16-4-6-21(13)2/h3-8H,1-2H3,(H,19,20,23).
What are the key properties of 5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 339.38 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[4-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 167960553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).