N-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide

C15H13N3OS — CID 18155731

IUPACN-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide
SMILESCc1ccnc(NC(=O)c2sccc2-n2cccc2)c1
InChIInChI=1S/C15H13N3OS/c1-11-4-6-16-13(10-11)17-15(19)14-12(5-9-20-14)18-7-2-3-8-18/h2-10H,1H3,(H,16,17,19)
InChIKeyIKZCRSNMKVEGTG-UHFFFAOYSA-N
MW283.36 g/mol
LogP3.49
Rot. Bonds3

About N-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide

N-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide (PubChem CID 18155731) has the molecular formula C15H13N3OS and a molecular weight of 283.36 g/mol. Its IUPAC name is N-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide
PubChem CID18155731
Molecular FormulaC15H13N3OS
Molecular Weight283.36 g/mol
Exact Mass283.08
IUPAC NameN-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide
SMILESCc1ccnc(NC(=O)c2sccc2-n2cccc2)c1
InChIInChI=1S/C15H13N3OS/c1-11-4-6-16-13(10-11)17-15(19)14-12(5-9-20-14)18-7-2-3-8-18/h2-10H,1H3,(H,16,17,19)
InChIKeyIKZCRSNMKVEGTG-UHFFFAOYSA-N
XLogP3.49
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.36
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-3-pyrrol-1-ylthiophene-2-carboxamide
CID 3694864
4-methyl-N-(4-methyl-2-pyridinyl)-1,3-thiazole-5-carboxamide
CID 47265636
N-(4-ethyl-1H-pyrazol-5-yl)-3-pyrrol-1-ylthiophene-2-carboxamide
CID 104620359
N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 46307927
2-N,6-N-bis(4-methyl-2-pyridinyl)pyridine-2,6-dicarboxamide
CID 4130002
N-[4-(hydroxymethyl)phenyl]-3-pyrrol-1-ylthiophene-2-carboxamide
CID 64792811
N-(2-methyl-4-pyrrolidin-1-ylphenyl)-3-pyrrol-1-ylthiophene-2-carboxamide
CID 18290314
N-[2-(2-methoxy-5-methylphenyl)ethyl]-3-pyrrol-1-ylthiophene-2-carboxamide
CID 24624690
5-[(3-pyrrol-1-ylthiophene-2-carbonyl)amino]thiophene-2-carboxylic acid
CID 43474607
3-hydroxy-N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 54861359
4-benzyl-N-(4-methyl-2-pyridinyl)thieno[3,2-b]pyrrole-5-carboxamide
CID 3860168
3,4-dichloro-N-(4-methyl-2-pyridinyl)-1-benzothiophene-2-carboxamide
CID 4676424

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide?
The IUPAC name of N-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide (CID 18155731) is N-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide.
What is the SMILES notation for N-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide?
The canonical SMILES for N-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide is Cc1ccnc(NC(=O)c2sccc2-n2cccc2)c1.
What is the InChIKey of N-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide?
The InChIKey is IKZCRSNMKVEGTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3OS/c1-11-4-6-16-13(10-11)17-15(19)14-12(5-9-20-14)18-7-2-3-8-18/h2-10H,1H3,(H,16,17,19).
What are the key properties of N-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide?
N-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide has a molecular weight of 283.36 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-pyridinyl)-3-pyrrol-1-ylthiophene-2-carboxamide is sourced from PubChem (CID 18155731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).