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

C16H20N4OS — CID 110253678

IUPAC6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide
SMILESCC(C)N1CCCC1c1cccc(C(=O)Nc2nccs2)n1
InChIInChI=1S/C16H20N4OS/c1-11(2)20-9-4-7-14(20)12-5-3-6-13(18-12)15(21)19-16-17-8-10-22-16/h3,5-6,8,10-11,14H,4,7,9H2,1-2H3,(H,17,19,21)
InChIKeyGIFJVPCUAITBQE-UHFFFAOYSA-N
MW316.43 g/mol
LogP3.34
Rot. Bonds4

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

6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide (PubChem CID 110253678) has the molecular formula C16H20N4OS and a molecular weight of 316.43 g/mol. Its IUPAC name is 6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide
PubChem CID110253678
Molecular FormulaC16H20N4OS
Molecular Weight316.43 g/mol
Exact Mass316.14
IUPAC Name6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide
SMILESCC(C)N1CCCC1c1cccc(C(=O)Nc2nccs2)n1
InChIInChI=1S/C16H20N4OS/c1-11(2)20-9-4-7-14(20)12-5-3-6-13(18-12)15(21)19-16-17-8-10-22-16/h3,5-6,8,10-11,14H,4,7,9H2,1-2H3,(H,17,19,21)
InChIKeyGIFJVPCUAITBQE-UHFFFAOYSA-N
XLogP3.34
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.43
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[1-(quinolin-5-ylmethyl)pyrrolidin-2-yl]-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide
CID 110252930
N-[2-methyl-6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidin-4-yl]-1,3-thiazol-2-amine
CID 95820390
(2R)-N-(1,3-thiazol-2-yl)-2-[(2R)-2-thiophen-3-ylpyrrolidin-1-yl]propanamide
CID 94032737
(2S)-N-(1,3-thiazol-2-yl)-2-[(2R)-2-thiophen-3-ylpyrrolidin-1-yl]propanamide
CID 94032736
6-[(2R)-1-acetylpyrrolidin-2-yl]-N-methylpyridine-2-carboxamide
CID 95816015
1-[6-[(2R)-1-propan-2-ylpyrrolidin-2-yl]-2-pyridinyl]piperidin-4-ol
CID 95825122
4-[(2R)-1-propan-2-ylpiperidin-2-yl]-N-pyrimidin-2-yl-1,3-thiazol-2-amine
CID 124976453
N-(1,3-thiazol-2-yl)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide
CID 4883035
2-[(2S)-2-[6-[(2-fluorophenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 95817937
2-(dimethylamino)-1-[(2R)-2-[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]pyrrolidin-1-yl]ethanone
CID 95835392
2-(1-propan-2-ylpiperidin-2-yl)-1,3-thiazole
CID 67986575
2-amino-1-[2-[6-(1,3-thiazol-2-ylamino)-2-pyridinyl]pyrrolidin-1-yl]ethanone;dihydrochloride
CID 171687472

Frequently Asked Questions

What is the IUPAC name of 6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide?
The IUPAC name of 6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide (CID 110253678) is 6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide is CC(C)N1CCCC1c1cccc(C(=O)Nc2nccs2)n1.
What is the InChIKey of 6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide?
The InChIKey is GIFJVPCUAITBQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4OS/c1-11(2)20-9-4-7-14(20)12-5-3-6-13(18-12)15(21)19-16-17-8-10-22-16/h3,5-6,8,10-11,14H,4,7,9H2,1-2H3,(H,17,19,21).
What are the key properties of 6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide?
6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide has a molecular weight of 316.43 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-propan-2-ylpyrrolidin-2-yl)-N-(1,3-thiazol-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 110253678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).