8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide

C19H13ClN4O2 — CID 2220993

IUPAC8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide
SMILESCc1cc(NC(=O)c2cc(-c3ccccn3)nc3c(Cl)cccc23)no1
InChIInChI=1S/C19H13ClN4O2/c1-11-9-17(24-26-11)23-19(25)13-10-16(15-7-2-3-8-21-15)22-18-12(13)5-4-6-14(18)20/h2-10H,1H3,(H,23,24,25)
InChIKeyBXPQQMVUQDWKQK-UHFFFAOYSA-N
MW364.79 g/mol
LogP4.50
Rot. Bonds3

About 8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide

8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide (PubChem CID 2220993) has the molecular formula C19H13ClN4O2 and a molecular weight of 364.79 g/mol. Its IUPAC name is 8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide.

Molecular Properties

Compound Name8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide
PubChem CID2220993
Molecular FormulaC19H13ClN4O2
Molecular Weight364.79 g/mol
Exact Mass364.07
IUPAC Name8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide
SMILESCc1cc(NC(=O)c2cc(-c3ccccn3)nc3c(Cl)cccc23)no1
InChIInChI=1S/C19H13ClN4O2/c1-11-9-17(24-26-11)23-19(25)13-10-16(15-7-2-3-8-21-15)22-18-12(13)5-4-6-14(18)20/h2-10H,1H3,(H,23,24,25)
InChIKeyBXPQQMVUQDWKQK-UHFFFAOYSA-N
XLogP4.50
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.79
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide?
The IUPAC name of 8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide (CID 2220993) is 8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide.
What is the SMILES notation for 8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide?
The canonical SMILES for 8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide is Cc1cc(NC(=O)c2cc(-c3ccccn3)nc3c(Cl)cccc23)no1.
What is the InChIKey of 8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide?
The InChIKey is BXPQQMVUQDWKQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13ClN4O2/c1-11-9-17(24-26-11)23-19(25)13-10-16(15-7-2-3-8-21-15)22-18-12(13)5-4-6-14(18)20/h2-10H,1H3,(H,23,24,25).
What are the key properties of 8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide?
8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide has a molecular weight of 364.79 g/mol, XLogP of 4.50, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide is sourced from PubChem (CID 2220993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).