N-(5-chloro-2-pyridinyl)quinoline-2-carboxamide

C15H10ClN3O — CID 886118

IUPACN-(5-chloro-2-pyridinyl)quinoline-2-carboxamide
SMILESO=C(Nc1ccc(Cl)cn1)c1ccc2ccccc2n1
InChIInChI=1S/C15H10ClN3O/c16-11-6-8-14(17-9-11)19-15(20)13-7-5-10-3-1-2-4-12(10)18-13/h1-9H,(H,17,19,20)
InChIKeyYCMBEPVEXUGHKC-UHFFFAOYSA-N
MW283.72 g/mol
LogP3.54
Rot. Bonds2

About N-(5-chloro-2-pyridinyl)quinoline-2-carboxamide

N-(5-chloro-2-pyridinyl)quinoline-2-carboxamide (PubChem CID 886118) has the molecular formula C15H10ClN3O and a molecular weight of 283.72 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)quinoline-2-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)quinoline-2-carboxamide
PubChem CID886118
Molecular FormulaC15H10ClN3O
Molecular Weight283.72 g/mol
Exact Mass283.05
IUPAC NameN-(5-chloro-2-pyridinyl)quinoline-2-carboxamide
SMILESO=C(Nc1ccc(Cl)cn1)c1ccc2ccccc2n1
InChIInChI=1S/C15H10ClN3O/c16-11-6-8-14(17-9-11)19-15(20)13-7-5-10-3-1-2-4-12(10)18-13/h1-9H,(H,17,19,20)
InChIKeyYCMBEPVEXUGHKC-UHFFFAOYSA-N
XLogP3.54
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.72
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)quinoline-2-carboxamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)quinoline-2-carboxamide (CID 886118) is N-(5-chloro-2-pyridinyl)quinoline-2-carboxamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)quinoline-2-carboxamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)quinoline-2-carboxamide is O=C(Nc1ccc(Cl)cn1)c1ccc2ccccc2n1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)quinoline-2-carboxamide?
The InChIKey is YCMBEPVEXUGHKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN3O/c16-11-6-8-14(17-9-11)19-15(20)13-7-5-10-3-1-2-4-12(10)18-13/h1-9H,(H,17,19,20).
What are the key properties of N-(5-chloro-2-pyridinyl)quinoline-2-carboxamide?
N-(5-chloro-2-pyridinyl)quinoline-2-carboxamide has a molecular weight of 283.72 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)quinoline-2-carboxamide is sourced from PubChem (CID 886118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).