7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C16H18N6OS — CID 110100954

IUPAC7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1cnn2c(C3CCCCN3Cc3cncs3)ccnc12
InChIInChI=1S/C16H18N6OS/c17-15(23)12-8-20-22-14(4-5-19-16(12)22)13-3-1-2-6-21(13)9-11-7-18-10-24-11/h4-5,7-8,10,13H,1-3,6,9H2,(H2,17,23)
InChIKeyMQZQTLKHHKGRTG-UHFFFAOYSA-N
MW342.43 g/mol
LogP2.01
Rot. Bonds4

About 7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 110100954) has the molecular formula C16H18N6OS and a molecular weight of 342.43 g/mol. Its IUPAC name is 7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID110100954
Molecular FormulaC16H18N6OS
Molecular Weight342.43 g/mol
Exact Mass342.13
IUPAC Name7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1cnn2c(C3CCCCN3Cc3cncs3)ccnc12
InChIInChI=1S/C16H18N6OS/c17-15(23)12-8-20-22-14(4-5-19-16(12)22)13-3-1-2-6-21(13)9-11-7-18-10-24-11/h4-5,7-8,10,13H,1-3,6,9H2,(H2,17,23)
InChIKeyMQZQTLKHHKGRTG-UHFFFAOYSA-N
XLogP2.01
TPSA89.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.43
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-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-[3-piperidin-4-yl-1-(1,3-thiazol-2-yl)pyrazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 68328671
N-[2-(2-pyrimidin-2-yl-1,3-thiazol-4-yl)ethyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
CID 56908721
(5-Methylpyrazolo[1,5-a]pyrimidin-3-yl)-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone
CID 72124141
(5-Methylpyrazolo[1,5-a]pyrimidin-3-yl)-[2-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone
CID 72134915
2-(2-Methyl-1,3-thiazol-4-YL)-1-(4-{pyrazolo[1,5-A]pyrimidin-5-YL}piperidin-1-YL)ethanone
CID 110132802
11-(2,4-Dimethyl-1,3-thiazole-5-carbonyl)-4-methyl-2,3,7,11-tetraazatricyclo[7.4.0.0^{2,6}]trideca-1(9),3,5,7-tetraene
CID 73168957
N-(1-cyclopropyl-2,2,2-trifluoroethyl)-7-methyl-5-(1,3-thiazol-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 132003573
5-cyclopropyl-7-(difluoromethyl)-N-(1,3-thiazol-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 4768579
5-cyclopropyl-7-(difluoromethyl)-N-(5-methyl-1,3-thiazol-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 4771111
7-(difluoromethyl)-5-(4-fluorophenyl)-N-(1,3-thiazol-2-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 4774395
N-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 25600416
N-[5-[(3-fluorophenyl)methyl]-1,3-thiazol-2-yl]-7-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 55853104

Frequently Asked Questions

What is the IUPAC name of 7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 110100954) is 7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is NC(=O)c1cnn2c(C3CCCCN3Cc3cncs3)ccnc12.
What is the InChIKey of 7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is MQZQTLKHHKGRTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N6OS/c17-15(23)12-8-20-22-14(4-5-19-16(12)22)13-3-1-2-6-21(13)9-11-7-18-10-24-11/h4-5,7-8,10,13H,1-3,6,9H2,(H2,17,23).
What are the key properties of 7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 342.43 g/mol, XLogP of 2.01, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[1-(1,3-thiazol-5-ylmethyl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 110100954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).