2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide

C17H15N3O2 — CID 24809725

IUPAC2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide
SMILESCOc1cccc(-c2[nH]c(-c3ccncc3)cc2C(N)=O)c1
InChIInChI=1S/C17H15N3O2/c1-22-13-4-2-3-12(9-13)16-14(17(18)21)10-15(20-16)11-5-7-19-8-6-11/h2-10,20H,1H3,(H2,18,21)
InChIKeyGQGDIBZCZVAYNM-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.85
Rot. Bonds4

About 2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide

2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide (PubChem CID 24809725) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide
PubChem CID24809725
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC Name2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide
SMILESCOc1cccc(-c2[nH]c(-c3ccncc3)cc2C(N)=O)c1
InChIInChI=1S/C17H15N3O2/c1-22-13-4-2-3-12(9-13)16-14(17(18)21)10-15(20-16)11-5-7-19-8-6-11/h2-10,20H,1H3,(H2,18,21)
InChIKeyGQGDIBZCZVAYNM-UHFFFAOYSA-N
XLogP2.85
TPSA81.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3-methoxyphenyl)-2-oxo-1H-pyrimidine-5-carboxylic acid
CID 82384684
ethyl 2-amino-5-(3-methoxyphenyl)-1H-pyrrole-3-carboxylate
CID 23282732
4-[2-(aminomethyl)phenyl]-2-(3-methoxyphenyl)-1H-indole-7-carboxamide
CID 174783705
4-(3-methoxyphenyl)-2-pyridin-4-yl-1H-pyrimidin-6-one
CID 139270583
4-[2-(3-methoxyphenyl)-4-phenyl-1H-imidazol-5-yl]pyridine
CID 10019342
ethyl 3-(3-methoxyphenyl)-7-oxo-2-pyridin-4-yl-1H-pyrazolo[1,5-a]pyrimidine-6-carboxylate
CID 66877516
1-(3-methoxyphenyl)-2-pyridin-4-ylethane-1,2-dione
CID 18704760
6-(3-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
CID 174777628
5-amino-2-(3-methoxyphenyl)-1,3-oxazole-4-carboxamide
CID 11658697
5-[4-(3-methoxyphenyl)phenyl]-2H-triazole-4-carboxamide
CID 169402846
3-amino-5,6-bis(3-methoxyphenyl)-1H-pyrazin-2-one
CID 132588517
2-amino-4-(3-methoxyphenyl)-1λ3-ioda-3-azacyclohexa-1,3,5-triene-6-carboxamide
CID 88884793

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide?
The IUPAC name of 2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide (CID 24809725) is 2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide.
What is the SMILES notation for 2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide?
The canonical SMILES for 2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide is COc1cccc(-c2[nH]c(-c3ccncc3)cc2C(N)=O)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide?
The InChIKey is GQGDIBZCZVAYNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-22-13-4-2-3-12(9-13)16-14(17(18)21)10-15(20-16)11-5-7-19-8-6-11/h2-10,20H,1H3,(H2,18,21).
What are the key properties of 2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide?
2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide has a molecular weight of 293.33 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-5-pyridin-4-yl-1H-pyrrole-3-carboxamide is sourced from PubChem (CID 24809725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).