N-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

C20H16N4O2 — CID 176656242

IUPACN-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
SMILESCOc1ccncc1NC(=O)c1c[nH]c2ncc(-c3ccccc3)cc12
InChIInChI=1S/C20H16N4O2/c1-26-18-7-8-21-12-17(18)24-20(25)16-11-23-19-15(16)9-14(10-22-19)13-5-3-2-4-6-13/h2-12H,1H3,(H,22,23)(H,24,25)
InChIKeyKJJDEBUFCIWXQD-UHFFFAOYSA-N
MW344.37 g/mol
LogP3.89
Rot. Bonds4

About N-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide

N-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide (PubChem CID 176656242) has the molecular formula C20H16N4O2 and a molecular weight of 344.37 g/mol. Its IUPAC name is N-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
PubChem CID176656242
Molecular FormulaC20H16N4O2
Molecular Weight344.37 g/mol
Exact Mass344.13
IUPAC NameN-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
SMILESCOc1ccncc1NC(=O)c1c[nH]c2ncc(-c3ccccc3)cc12
InChIInChI=1S/C20H16N4O2/c1-26-18-7-8-21-12-17(18)24-20(25)16-11-23-19-15(16)9-14(10-22-19)13-5-3-2-4-6-13/h2-12H,1H3,(H,22,23)(H,24,25)
InChIKeyKJJDEBUFCIWXQD-UHFFFAOYSA-N
XLogP3.89
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-methyl-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 176656234
N-(4-methoxy-3-pyridinyl)-1H-pyrrole-2-carboxamide
CID 118959108
N-[3-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]acetamide;silver
CID 131739517
N-[5-(3,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-phenylacetamide
CID 155556093
5-phenyl-1H-pyrrolo[2,3-b]pyridin-3-ol
CID 133091526
(2,5-dimethylpyrazol-3-yl)-(5-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
CID 71219030
5-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]pyridine-3-carboxamide
CID 25166699
[3-[ethyl(methyl)amino]-2-fluoro-6-methoxyphenyl]-(5-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
CID 143385057
N-(2-methoxy-5-phenylphenyl)-1H-imidazole-2-carboxamide
CID 86010017
N-(2-methoxyphenyl)-3-(propylamino)pyridine-4-carboxamide
CID 105067884
6-amino-N-(2-methoxyphenyl)-1H-indole-3-carboxamide
CID 61089726
5-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]-N-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 11562287

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide?
The IUPAC name of N-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide (CID 176656242) is N-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide.
What is the SMILES notation for N-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide?
The canonical SMILES for N-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide is COc1ccncc1NC(=O)c1c[nH]c2ncc(-c3ccccc3)cc12.
What is the InChIKey of N-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide?
The InChIKey is KJJDEBUFCIWXQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O2/c1-26-18-7-8-21-12-17(18)24-20(25)16-11-23-19-15(16)9-14(10-22-19)13-5-3-2-4-6-13/h2-12H,1H3,(H,22,23)(H,24,25).
What are the key properties of N-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide?
N-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide has a molecular weight of 344.37 g/mol, XLogP of 3.89, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-3-pyridinyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide is sourced from PubChem (CID 176656242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).