N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide

C14H15N5O2S — CID 166216677

IUPACN-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
SMILESCc1nsc(NC(=O)c2cccc(C(=O)N3CCCC3)n2)n1
InChIInChI=1S/C14H15N5O2S/c1-9-15-14(22-18-9)17-12(20)10-5-4-6-11(16-10)13(21)19-7-2-3-8-19/h4-6H,2-3,7-8H2,1H3,(H,15,17,18,20)
InChIKeyWQOMVNINTRMNDR-UHFFFAOYSA-N
MW317.37 g/mol
LogP1.73
Rot. Bonds3

About N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide

N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide (PubChem CID 166216677) has the molecular formula C14H15N5O2S and a molecular weight of 317.37 g/mol. Its IUPAC name is N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
PubChem CID166216677
Molecular FormulaC14H15N5O2S
Molecular Weight317.37 g/mol
Exact Mass317.09
IUPAC NameN-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
SMILESCc1nsc(NC(=O)c2cccc(C(=O)N3CCCC3)n2)n1
InChIInChI=1S/C14H15N5O2S/c1-9-15-14(22-18-9)17-12(20)10-5-4-6-11(16-10)13(21)19-7-2-3-8-19/h4-6H,2-3,7-8H2,1H3,(H,15,17,18,20)
InChIKeyWQOMVNINTRMNDR-UHFFFAOYSA-N
XLogP1.73
TPSA88.08 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.37
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-acetamidophenyl)-6-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095228
6-(azepane-1-carbonyl)-N-(2,6-dichlorophenyl)pyridine-2-carboxamide
CID 109099941
N-(2,6-dichlorophenyl)-6-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095252
N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide
CID 116658033
N-(2-chlorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109094857
6-(azepane-1-carbonyl)-N-(3-chloro-4-methylphenyl)pyridine-2-carboxamide
CID 109099901
N-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109094861
methyl 4-[[6-(azepane-1-carbonyl)pyridine-2-carbonyl]amino]benzoate
CID 109099926
N-(2-ethylphenyl)-6-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095186
N-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109094901
N-(2-methylpropyl)-6-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109094386
6-(piperidine-1-carbonyl)pyridine-2-carboxylic acid
CID 43558285

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide?
The IUPAC name of N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide (CID 166216677) is N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide?
The canonical SMILES for N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide is Cc1nsc(NC(=O)c2cccc(C(=O)N3CCCC3)n2)n1.
What is the InChIKey of N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide?
The InChIKey is WQOMVNINTRMNDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O2S/c1-9-15-14(22-18-9)17-12(20)10-5-4-6-11(16-10)13(21)19-7-2-3-8-19/h4-6H,2-3,7-8H2,1H3,(H,15,17,18,20).
What are the key properties of N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide?
N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide has a molecular weight of 317.37 g/mol, XLogP of 1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-1,2,4-thiadiazol-5-yl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide is sourced from PubChem (CID 166216677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).