N-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide

C15H11N3O2 — CID 150453175

IUPACN-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide
SMILESO=Cc1c[nH]c2ccc(NC(=O)c3ccncc3)cc12
InChIInChI=1S/C15H11N3O2/c19-9-11-8-17-14-2-1-12(7-13(11)14)18-15(20)10-3-5-16-6-4-10/h1-9,17H,(H,18,20)
InChIKeyHOFUGPUAIQCMAJ-UHFFFAOYSA-N
MW265.27 g/mol
LogP2.63
Rot. Bonds3

About N-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide

N-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide (PubChem CID 150453175) has the molecular formula C15H11N3O2 and a molecular weight of 265.27 g/mol. Its IUPAC name is N-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide
PubChem CID150453175
Molecular FormulaC15H11N3O2
Molecular Weight265.27 g/mol
Exact Mass265.09
IUPAC NameN-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide
SMILESO=Cc1c[nH]c2ccc(NC(=O)c3ccncc3)cc12
InChIInChI=1S/C15H11N3O2/c19-9-11-8-17-14-2-1-12(7-13(11)14)18-15(20)10-3-5-16-6-4-10/h1-9,17H,(H,18,20)
InChIKeyHOFUGPUAIQCMAJ-UHFFFAOYSA-N
XLogP2.63
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)pyridine-4-carboxamide
CID 26663415
N-(3H-benzimidazol-5-yl)pyridine-4-carboxamide;hydrochloride
CID 110778958
N-(1H-indol-3-ylmethylideneamino)pyridine-4-carboxamide
CID 5488
N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide
CID 22479938
N-(3,4-dibromophenyl)pyridine-4-carboxamide
CID 4139948
3-(5-bromo-1H-indol-3-yl)-1-pyridin-4-ylprop-2-en-1-one
CID 2834982
5-(6-formyl-1,3-benzodioxol-5-yl)-N-pyridin-4-yl-1H-indole-3-carboxamide
CID 175282638
methanol;N-pyridin-4-ylpyridine-4-carboxamide
CID 158472241
(2S)-2-(5-benzamido-1H-indol-3-yl)-2-[4-(2-pyridin-4-ylethyl)piperazin-1-yl]acetic acid
CID 39033906
4-[2-(1H-indol-3-yl)ethylamino]-N-pyridin-4-ylbenzamide
CID 59555813
2-(5-benzamido-1H-indol-3-yl)-2-(4-methylpiperazin-1-yl)acetic acid
CID 45495903
(2S)-2-(5-benzamido-1H-indol-3-yl)-2-(4-methylpiperazin-1-yl)acetic acid
CID 51721906

Frequently Asked Questions

What is the IUPAC name of N-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide?
The IUPAC name of N-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide (CID 150453175) is N-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide.
What is the SMILES notation for N-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide?
The canonical SMILES for N-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide is O=Cc1c[nH]c2ccc(NC(=O)c3ccncc3)cc12.
What is the InChIKey of N-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide?
The InChIKey is HOFUGPUAIQCMAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O2/c19-9-11-8-17-14-2-1-12(7-13(11)14)18-15(20)10-3-5-16-6-4-10/h1-9,17H,(H,18,20).
What are the key properties of N-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide?
N-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide has a molecular weight of 265.27 g/mol, XLogP of 2.63, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-formyl-1H-indol-5-yl)pyridine-4-carboxamide is sourced from PubChem (CID 150453175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).