5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide

C11H11N3O — CID 86274983

IUPAC5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide
SMILESCc1[nH]c(C(N)=O)cc1-c1ccncc1
InChIInChI=1S/C11H11N3O/c1-7-9(6-10(14-7)11(12)15)8-2-4-13-5-3-8/h2-6,14H,1H3,(H2,12,15)
InChIKeyAVXCUBXPESXCQR-UHFFFAOYSA-N
MW201.23 g/mol
LogP1.48
Rot. Bonds2

About 5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide

5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide (PubChem CID 86274983) has the molecular formula C11H11N3O and a molecular weight of 201.23 g/mol. Its IUPAC name is 5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound Name5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide
PubChem CID86274983
Molecular FormulaC11H11N3O
Molecular Weight201.23 g/mol
Exact Mass201.09
IUPAC Name5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide
SMILESCc1[nH]c(C(N)=O)cc1-c1ccncc1
InChIInChI=1S/C11H11N3O/c1-7-9(6-10(14-7)11(12)15)8-2-4-13-5-3-8/h2-6,14H,1H3,(H2,12,15)
InChIKeyAVXCUBXPESXCQR-UHFFFAOYSA-N
XLogP1.48
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

FG-7142
CID 4375
Phenyl(1H-pyrrol-2-YL)methanone
CID 24370
Bupicomide
CID 31447
Lsn2463359
CID 72551298
1H-pyrrole-2-carboxamide
CID 573553
N-(3-(trifluoromethyl)phenyl)pyridine-2-carboxamide
CID 2306530
N-[(4-fluorophenyl)methyl]-1H-pyrrole-2-carboxamide
CID 1489242
Pha-767491
CID 11715767
(1H-indol-2-yl)(4-methylpiperazin-1-yl)methanone
CID 4060730
(4-ethylpiperazin-1-yl)(1H-indol-2-yl)methanone
CID 11821243
2-Ethylisonicotinamide
CID 76905
N-methyl-N-(2-phenylethyl)-1H-pyrrole-2-carboxamide
CID 16110287

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide?
The IUPAC name of 5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide (CID 86274983) is 5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide.
What is the SMILES notation for 5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide?
The canonical SMILES for 5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide is Cc1[nH]c(C(N)=O)cc1-c1ccncc1.
What is the InChIKey of 5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide?
The InChIKey is AVXCUBXPESXCQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c1-7-9(6-10(14-7)11(12)15)8-2-4-13-5-3-8/h2-6,14H,1H3,(H2,12,15).
What are the key properties of 5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide?
5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide has a molecular weight of 201.23 g/mol, XLogP of 1.48, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-pyridin-4-yl-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 86274983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).