3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride

C17H19ClN4OS — CID 68626860

IUPAC3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride
SMILESCl.NC(=O)c1cc(-c2ccsc2)cc2c(C3CCNCC3)[nH]nc12
InChIInChI=1S/C17H18N4OS.ClH/c18-17(22)14-8-12(11-3-6-23-9-11)7-13-15(20-21-16(13)14)10-1-4-19-5-2-10;/h3,6-10,19H,1-2,4-5H2,(H2,18,22)(H,20,21);1H
InChIKeyUJERFPMIOWSMOG-UHFFFAOYSA-N
MW362.89 g/mol
LogP3.28
Rot. Bonds3

About 3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride

3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride (PubChem CID 68626860) has the molecular formula C17H19ClN4OS and a molecular weight of 362.89 g/mol. Its IUPAC name is 3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride
PubChem CID68626860
Molecular FormulaC17H19ClN4OS
Molecular Weight362.89 g/mol
Exact Mass362.10
IUPAC Name3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride
SMILESCl.NC(=O)c1cc(-c2ccsc2)cc2c(C3CCNCC3)[nH]nc12
InChIInChI=1S/C17H18N4OS.ClH/c18-17(22)14-8-12(11-3-6-23-9-11)7-13-15(20-21-16(13)14)10-1-4-19-5-2-10;/h3,6-10,19H,1-2,4-5H2,(H2,18,22)(H,20,21);1H
InChIKeyUJERFPMIOWSMOG-UHFFFAOYSA-N
XLogP3.28
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.89
LogP ≤ 53.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride?
The IUPAC name of 3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride (CID 68626860) is 3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride.
What is the SMILES notation for 3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride?
The canonical SMILES for 3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride is Cl.NC(=O)c1cc(-c2ccsc2)cc2c(C3CCNCC3)[nH]nc12.
What is the InChIKey of 3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride?
The InChIKey is UJERFPMIOWSMOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4OS.ClH/c18-17(22)14-8-12(11-3-6-23-9-11)7-13-15(20-21-16(13)14)10-1-4-19-5-2-10;/h3,6-10,19H,1-2,4-5H2,(H2,18,22)(H,20,21);1H.
What are the key properties of 3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride?
3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride has a molecular weight of 362.89 g/mol, XLogP of 3.28, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-4-yl-5-thiophen-3-yl-2H-indazole-7-carboxamide;hydrochloride is sourced from PubChem (CID 68626860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).