6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide

C13H14N4OS — CID 66509656

IUPAC6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
SMILESO=C(Nc1nccs1)c1ccc(C2CCCN2)nc1
InChIInChI=1S/C13H14N4OS/c18-12(17-13-15-6-7-19-13)9-3-4-11(16-8-9)10-2-1-5-14-10/h3-4,6-8,10,14H,1-2,5H2,(H,15,17,18)
InChIKeyVDXKPADAEQVXEI-UHFFFAOYSA-N
MW274.35 g/mol
LogP2.21
Rot. Bonds3

About 6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide

6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide (PubChem CID 66509656) has the molecular formula C13H14N4OS and a molecular weight of 274.35 g/mol. Its IUPAC name is 6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
PubChem CID66509656
Molecular FormulaC13H14N4OS
Molecular Weight274.35 g/mol
Exact Mass274.09
IUPAC Name6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
SMILESO=C(Nc1nccs1)c1ccc(C2CCCN2)nc1
InChIInChI=1S/C13H14N4OS/c18-12(17-13-15-6-7-19-13)9-3-4-11(16-8-9)10-2-1-5-14-10/h3-4,6-8,10,14H,1-2,5H2,(H,15,17,18)
InChIKeyVDXKPADAEQVXEI-UHFFFAOYSA-N
XLogP2.21
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.35
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-piperidin-4-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 110085479
methyl 6-piperidin-2-ylpyridine-3-carboxylate
CID 115032044
6-(methylamino)-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 62171449
6-[(2R)-1-[3-(4-fluorophenyl)propanoyl]pyrrolidin-2-yl]-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 92623632
4-fluoro-N-(4-pyrrolidin-2-yl-1,3-thiazol-2-yl)benzamide
CID 132648757
4-[6-[(2R)-pyrrolidin-2-yl]-3-pyridinyl]benzoic acid
CID 124993884
6-[1-[2-(3-methylpiperidin-1-yl)acetyl]piperidin-4-yl]-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 110264374
N-(1,3-thiazol-2-yl)azetidine-2-carboxamide
CID 130992868
4-(1H-pyrazol-4-yl)-N-(1,3-thiazol-2-yl)benzamide
CID 110464300
6-[(2R)-1-[2-(2-methyl-1,3-thiazol-4-yl)acetyl]pyrrolidin-2-yl]-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 92623199
6-[1-[2-(2-fluorophenoxy)acetyl]pyrrolidin-2-yl]-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 110264472
6-[(2S)-pyrrolidin-2-yl]pyridin-3-ol
CID 55275999

Frequently Asked Questions

What is the IUPAC name of 6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide?
The IUPAC name of 6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide (CID 66509656) is 6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide is O=C(Nc1nccs1)c1ccc(C2CCCN2)nc1.
What is the InChIKey of 6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide?
The InChIKey is VDXKPADAEQVXEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4OS/c18-12(17-13-15-6-7-19-13)9-3-4-11(16-8-9)10-2-1-5-14-10/h3-4,6-8,10,14H,1-2,5H2,(H,15,17,18).
What are the key properties of 6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide?
6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide has a molecular weight of 274.35 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-pyrrolidin-2-yl-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 66509656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).