5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide

C21H17N3O3 — CID 57344659

IUPAC5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide
SMILESCOc1cc2cc(C(=O)Nc3ccc(Oc4ccccc4)cc3)[nH]c2cn1
InChIInChI=1S/C21H17N3O3/c1-26-20-12-14-11-18(24-19(14)13-22-20)21(25)23-15-7-9-17(10-8-15)27-16-5-3-2-4-6-16/h2-13,24H,1H3,(H,23,25)
InChIKeyHEGUJQDSHPLSEU-UHFFFAOYSA-N
MW359.39 g/mol
LogP4.62
Rot. Bonds5

About 5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide

5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide (PubChem CID 57344659) has the molecular formula C21H17N3O3 and a molecular weight of 359.39 g/mol. Its IUPAC name is 5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide
PubChem CID57344659
Molecular FormulaC21H17N3O3
Molecular Weight359.39 g/mol
Exact Mass359.13
IUPAC Name5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide
SMILESCOc1cc2cc(C(=O)Nc3ccc(Oc4ccccc4)cc3)[nH]c2cn1
InChIInChI=1S/C21H17N3O3/c1-26-20-12-14-11-18(24-19(14)13-22-20)21(25)23-15-7-9-17(10-8-15)27-16-5-3-2-4-6-16/h2-13,24H,1H3,(H,23,25)
InChIKeyHEGUJQDSHPLSEU-UHFFFAOYSA-N
XLogP4.62
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.39
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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5,6-dihydroxy-N-phenyl-1H-indole-2-carboxamide
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N-(4-acetamidophenyl)-4-phenoxybenzamide
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N-(4-ethylphenyl)-6-methoxy-1H-indole-2-carboxamide
CID 46555962
N-(3-methoxyphenyl)-6-methyl-1H-indole-2-carboxamide
CID 113207365
7-amino-N-(4-methoxyphenyl)-1H-indole-2-carboxamide
CID 62057891
N-(4-methoxyphenyl)-2-phenoxypyridine-3-carboxamide
CID 24513637
N-[4-(2-methoxyethoxy)phenyl]-6-phenoxypyridine-3-carboxamide
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N-(4-methoxyphenyl)-4-(4-methylphenoxy)benzamide
CID 16651033

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide?
The IUPAC name of 5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide (CID 57344659) is 5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for 5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for 5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide is COc1cc2cc(C(=O)Nc3ccc(Oc4ccccc4)cc3)[nH]c2cn1.
What is the InChIKey of 5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide?
The InChIKey is HEGUJQDSHPLSEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O3/c1-26-20-12-14-11-18(24-19(14)13-22-20)21(25)23-15-7-9-17(10-8-15)27-16-5-3-2-4-6-16/h2-13,24H,1H3,(H,23,25).
What are the key properties of 5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide?
5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide has a molecular weight of 359.39 g/mol, XLogP of 4.62, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-(4-phenoxyphenyl)-1H-pyrrolo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 57344659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).