N-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide

C11H11N3O — CID 110691028

IUPACN-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide
SMILESCc1cc(NC(=O)c2ccc[nH]2)ccn1
InChIInChI=1S/C11H11N3O/c1-8-7-9(4-6-12-8)14-11(15)10-3-2-5-13-10/h2-7,13H,1H3,(H,12,14,15)
InChIKeyDFBKCHSNZCSUJC-UHFFFAOYSA-N
MW201.23 g/mol
LogP1.97
Rot. Bonds2

About N-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide

N-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide (PubChem CID 110691028) has the molecular formula C11H11N3O and a molecular weight of 201.23 g/mol. Its IUPAC name is N-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide
PubChem CID110691028
Molecular FormulaC11H11N3O
Molecular Weight201.23 g/mol
Exact Mass201.09
IUPAC NameN-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide
SMILESCc1cc(NC(=O)c2ccc[nH]2)ccn1
InChIInChI=1S/C11H11N3O/c1-8-7-9(4-6-12-8)14-11(15)10-3-2-5-13-10/h2-7,13H,1H3,(H,12,14,15)
InChIKeyDFBKCHSNZCSUJC-UHFFFAOYSA-N
XLogP1.97
TPSA57.78 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 ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide?
The IUPAC name of N-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide (CID 110691028) is N-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide.
What is the SMILES notation for N-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide?
The canonical SMILES for N-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide is Cc1cc(NC(=O)c2ccc[nH]2)ccn1.
What is the InChIKey of N-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide?
The InChIKey is DFBKCHSNZCSUJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c1-8-7-9(4-6-12-8)14-11(15)10-3-2-5-13-10/h2-7,13H,1H3,(H,12,14,15).
What are the key properties of N-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide?
N-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide has a molecular weight of 201.23 g/mol, XLogP of 1.97, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-4-pyridinyl)-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 110691028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).