N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide

C19H20N4O2 — CID 110901915

IUPACN-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide
SMILESO=C(Nc1ccccc1N1CCC(O)CC1)c1cccc2cn[nH]c12
InChIInChI=1S/C19H20N4O2/c24-14-8-10-23(11-9-14)17-7-2-1-6-16(17)21-19(25)15-5-3-4-13-12-20-22-18(13)15/h1-7,12,14,24H,8-11H2,(H,20,22)(H,21,25)
InChIKeyCSNOHDJTKGTGDX-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.78
Rot. Bonds3

About N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide

N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide (PubChem CID 110901915) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide.

Molecular Properties

Compound NameN-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide
PubChem CID110901915
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC NameN-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide
SMILESO=C(Nc1ccccc1N1CCC(O)CC1)c1cccc2cn[nH]c12
InChIInChI=1S/C19H20N4O2/c24-14-8-10-23(11-9-14)17-7-2-1-6-16(17)21-19(25)15-5-3-4-13-12-20-22-18(13)15/h1-7,12,14,24H,8-11H2,(H,20,22)(H,21,25)
InChIKeyCSNOHDJTKGTGDX-UHFFFAOYSA-N
XLogP2.78
TPSA81.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide?
The IUPAC name of N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide (CID 110901915) is N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide.
What is the SMILES notation for N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide?
The canonical SMILES for N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide is O=C(Nc1ccccc1N1CCC(O)CC1)c1cccc2cn[nH]c12.
What is the InChIKey of N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide?
The InChIKey is CSNOHDJTKGTGDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c24-14-8-10-23(11-9-14)17-7-2-1-6-16(17)21-19(25)15-5-3-4-13-12-20-22-18(13)15/h1-7,12,14,24H,8-11H2,(H,20,22)(H,21,25).
What are the key properties of N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide?
N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide has a molecular weight of 336.40 g/mol, XLogP of 2.78, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1H-indazole-7-carboxamide is sourced from PubChem (CID 110901915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).