6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride

C17H14ClN3OS — CID 45264992

IUPAC6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride
SMILESCl.O=C1CCc2cc(-c3csc(-c4cccnc4)n3)ccc2N1
InChIInChI=1S/C17H13N3OS.ClH/c21-16-6-4-11-8-12(3-5-14(11)19-16)15-10-22-17(20-15)13-2-1-7-18-9-13;/h1-3,5,7-10H,4,6H2,(H,19,21);1H
InChIKeyNJCLZCVIAGOJKM-UHFFFAOYSA-N
MW343.84 g/mol
LogP4.18
Rot. Bonds2

About 6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride

6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride (PubChem CID 45264992) has the molecular formula C17H14ClN3OS and a molecular weight of 343.84 g/mol. Its IUPAC name is 6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride.

Molecular Properties

Compound Name6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride
PubChem CID45264992
Molecular FormulaC17H14ClN3OS
Molecular Weight343.84 g/mol
Exact Mass343.05
IUPAC Name6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride
SMILESCl.O=C1CCc2cc(-c3csc(-c4cccnc4)n3)ccc2N1
InChIInChI=1S/C17H13N3OS.ClH/c21-16-6-4-11-8-12(3-5-14(11)19-16)15-10-22-17(20-15)13-2-1-7-18-9-13;/h1-3,5,7-10H,4,6H2,(H,19,21);1H
InChIKeyNJCLZCVIAGOJKM-UHFFFAOYSA-N
XLogP4.18
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.84
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride with MolForge

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Related Compounds

4-Amino-3-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10171950
4-Phenyl-3-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10193998
3-[2-(Pyridin-3-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10236551
4-Amino-6-(piperidin-1-yl)-3-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10237718
3-[2-(Pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10308461
6-Fluoro-3-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 10308615
3,4-Dihydro-6-(2-methyl-4-thiazolyl)-2(1H)-quinolinone
CID 2801266
N-[4-(propan-2-yl)phenyl]-4-[2-(pyridin-4-yl)ethyl]-1,3-thiazole-5-carboxamide
CID 23644838
4-Methyl-3-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]-1,2-dihydroquinolin-2-one
CID 22638519
N-[4-(2-Pyridin-3-yl-thiazol-4-yl)-phenyl]-acetamide
CID 884114
N-[4-(2-Pyridin-3-yl-thiazol-4-yl)-phenyl]-butyramide
CID 6487931
1-(2-pyridinylmethyl)-N-[3-(1,3-thiazol-4-yl)phenyl]-4-piperidinecarboxamide
CID 24791083

Frequently Asked Questions

What is the IUPAC name of 6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride?
The IUPAC name of 6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride (CID 45264992) is 6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride.
What is the SMILES notation for 6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride?
The canonical SMILES for 6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride is Cl.O=C1CCc2cc(-c3csc(-c4cccnc4)n3)ccc2N1.
What is the InChIKey of 6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride?
The InChIKey is NJCLZCVIAGOJKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3OS.ClH/c21-16-6-4-11-8-12(3-5-14(11)19-16)15-10-22-17(20-15)13-2-1-7-18-9-13;/h1-3,5,7-10H,4,6H2,(H,19,21);1H.
What are the key properties of 6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride?
6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride has a molecular weight of 343.84 g/mol, XLogP of 4.18, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-pyridin-3-yl-1,3-thiazol-4-yl)-3,4-dihydro-1H-quinolin-2-one;hydrochloride is sourced from PubChem (CID 45264992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).