6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide

C17H15ClN4O — CID 86772174

IUPAC6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide
SMILESO=C(NC1CCc2nccn2C1)c1cc(Cl)cc2cccnc12
InChIInChI=1S/C17H15ClN4O/c18-12-8-11-2-1-5-20-16(11)14(9-12)17(23)21-13-3-4-15-19-6-7-22(15)10-13/h1-2,5-9,13H,3-4,10H2,(H,21,23)
InChIKeyJLIRRTLMPVJRNR-UHFFFAOYSA-N
MW326.79 g/mol
LogP2.83
Rot. Bonds2

About 6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide

6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide (PubChem CID 86772174) has the molecular formula C17H15ClN4O and a molecular weight of 326.79 g/mol. Its IUPAC name is 6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide
PubChem CID86772174
Molecular FormulaC17H15ClN4O
Molecular Weight326.79 g/mol
Exact Mass326.09
IUPAC Name6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide
SMILESO=C(NC1CCc2nccn2C1)c1cc(Cl)cc2cccnc12
InChIInChI=1S/C17H15ClN4O/c18-12-8-11-2-1-5-20-16(11)14(9-12)17(23)21-13-3-4-15-19-6-7-22(15)10-13/h1-2,5-9,13H,3-4,10H2,(H,21,23)
InChIKeyJLIRRTLMPVJRNR-UHFFFAOYSA-N
XLogP2.83
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.79
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide?
The IUPAC name of 6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide (CID 86772174) is 6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide.
What is the SMILES notation for 6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide?
The canonical SMILES for 6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide is O=C(NC1CCc2nccn2C1)c1cc(Cl)cc2cccnc12.
What is the InChIKey of 6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide?
The InChIKey is JLIRRTLMPVJRNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN4O/c18-12-8-11-2-1-5-20-16(11)14(9-12)17(23)21-13-3-4-15-19-6-7-22(15)10-13/h1-2,5-9,13H,3-4,10H2,(H,21,23).
What are the key properties of 6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide?
6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide has a molecular weight of 326.79 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)quinoline-8-carboxamide is sourced from PubChem (CID 86772174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).