2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide

C18H13N5OS — CID 90509900

IUPAC2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1cccc2cccnc12)c1csc(Nc2ccccn2)n1
InChIInChI=1S/C18H13N5OS/c24-17(21-13-7-3-5-12-6-4-10-20-16(12)13)14-11-25-18(22-14)23-15-8-1-2-9-19-15/h1-11H,(H,21,24)(H,19,22,23)
InChIKeyYQWYLGBJKHYOTQ-UHFFFAOYSA-N
MW347.40 g/mol
LogP4.08
Rot. Bonds4

About 2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide

2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide (PubChem CID 90509900) has the molecular formula C18H13N5OS and a molecular weight of 347.40 g/mol. Its IUPAC name is 2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide
PubChem CID90509900
Molecular FormulaC18H13N5OS
Molecular Weight347.40 g/mol
Exact Mass347.08
IUPAC Name2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1cccc2cccnc12)c1csc(Nc2ccccn2)n1
InChIInChI=1S/C18H13N5OS/c24-17(21-13-7-3-5-12-6-4-10-20-16(12)13)14-11-25-18(22-14)23-15-8-1-2-9-19-15/h1-11H,(H,21,24)(H,19,22,23)
InChIKeyYQWYLGBJKHYOTQ-UHFFFAOYSA-N
XLogP4.08
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.40
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90509789
N-propan-2-yl-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90509762
N-(6-chloro-3-pyridinyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90509919
N-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90509804
N-quinolin-8-yl-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 17447095
N'-pyridin-2-yl-N-quinolin-8-yloxamide
CID 108525948
1-pyridin-2-yl-3-quinolin-8-ylurea
CID 110491789
N-(4-methylsulfonylphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90509926
N-(2-methylpropyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90509763
N-pyridin-2-ylquinolin-8-amine
CID 82537542
N-(2-chloro-3-pyridinyl)-2-(pyrimidin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90506088
N-[3-(difluoromethoxy)phenyl]-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90509910

Frequently Asked Questions

What is the IUPAC name of 2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide (CID 90509900) is 2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide is O=C(Nc1cccc2cccnc12)c1csc(Nc2ccccn2)n1.
What is the InChIKey of 2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide?
The InChIKey is YQWYLGBJKHYOTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N5OS/c24-17(21-13-7-3-5-12-6-4-10-20-16(12)13)14-11-25-18(22-14)23-15-8-1-2-9-19-15/h1-11H,(H,21,24)(H,19,22,23).
What are the key properties of 2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide?
2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide has a molecular weight of 347.40 g/mol, XLogP of 4.08, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 90509900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).