N-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide

C19H14N4O — CID 118947884

IUPACN-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide
SMILESO=C(c1ccccc1)N(c1cccnc1)c1ccc2[nH]ncc2c1
InChIInChI=1S/C19H14N4O/c24-19(14-5-2-1-3-6-14)23(17-7-4-10-20-13-17)16-8-9-18-15(11-16)12-21-22-18/h1-13H,(H,21,22)
InChIKeyATYFTEIEBHTWAD-UHFFFAOYSA-N
MW314.35 g/mol
LogP3.94
Rot. Bonds3

About N-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide

N-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide (PubChem CID 118947884) has the molecular formula C19H14N4O and a molecular weight of 314.35 g/mol. Its IUPAC name is N-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound NameN-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide
PubChem CID118947884
Molecular FormulaC19H14N4O
Molecular Weight314.35 g/mol
Exact Mass314.12
IUPAC NameN-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide
SMILESO=C(c1ccccc1)N(c1cccnc1)c1ccc2[nH]ncc2c1
InChIInChI=1S/C19H14N4O/c24-19(14-5-2-1-3-6-14)23(17-7-4-10-20-13-17)16-8-9-18-15(11-16)12-21-22-18/h1-13H,(H,21,22)
InChIKeyATYFTEIEBHTWAD-UHFFFAOYSA-N
XLogP3.94
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.35
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide?
The IUPAC name of N-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide (CID 118947884) is N-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide.
What is the SMILES notation for N-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide?
The canonical SMILES for N-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide is O=C(c1ccccc1)N(c1cccnc1)c1ccc2[nH]ncc2c1.
What is the InChIKey of N-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide?
The InChIKey is ATYFTEIEBHTWAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4O/c24-19(14-5-2-1-3-6-14)23(17-7-4-10-20-13-17)16-8-9-18-15(11-16)12-21-22-18/h1-13H,(H,21,22).
What are the key properties of N-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide?
N-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide has a molecular weight of 314.35 g/mol, XLogP of 3.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-5-yl)-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 118947884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).