4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide

C10H11N5OS — CID 145143053

IUPAC4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
SMILESNC(=O)c1n[nH]c2c1C(c1nccs1)NCC2
InChIInChI=1S/C10H11N5OS/c11-9(16)7-6-5(14-15-7)1-2-12-8(6)10-13-3-4-17-10/h3-4,8,12H,1-2H2,(H2,11,16)(H,14,15)
InChIKeyWRBRTDNVYSBWKF-UHFFFAOYSA-N
MW249.30 g/mol
LogP0.20
Rot. Bonds2

About 4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide

4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide (PubChem CID 145143053) has the molecular formula C10H11N5OS and a molecular weight of 249.30 g/mol. Its IUPAC name is 4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
PubChem CID145143053
Molecular FormulaC10H11N5OS
Molecular Weight249.30 g/mol
Exact Mass249.07
IUPAC Name4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
SMILESNC(=O)c1n[nH]c2c1C(c1nccs1)NCC2
InChIInChI=1S/C10H11N5OS/c11-9(16)7-6-5(14-15-7)1-2-12-8(6)10-13-3-4-17-10/h3-4,8,12H,1-2H2,(H2,11,16)(H,14,15)
InChIKeyWRBRTDNVYSBWKF-UHFFFAOYSA-N
XLogP0.20
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.30
LogP ≤ 50.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide?
The IUPAC name of 4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide (CID 145143053) is 4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide.
What is the SMILES notation for 4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide?
The canonical SMILES for 4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide is NC(=O)c1n[nH]c2c1C(c1nccs1)NCC2.
What is the InChIKey of 4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide?
The InChIKey is WRBRTDNVYSBWKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5OS/c11-9(16)7-6-5(14-15-7)1-2-12-8(6)10-13-3-4-17-10/h3-4,8,12H,1-2H2,(H2,11,16)(H,14,15).
What are the key properties of 4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide?
4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide has a molecular weight of 249.30 g/mol, XLogP of 0.20, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,3-thiazol-2-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide is sourced from PubChem (CID 145143053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).