N-(6-chloroquinolin-8-yl)furan-2-carboxamide

C14H9ClN2O2 — CID 60729929

IUPACN-(6-chloroquinolin-8-yl)furan-2-carboxamide
SMILESO=C(Nc1cc(Cl)cc2cccnc12)c1ccco1
InChIInChI=1S/C14H9ClN2O2/c15-10-7-9-3-1-5-16-13(9)11(8-10)17-14(18)12-4-2-6-19-12/h1-8H,(H,17,18)
InChIKeyVBAFLCSDFZUHHY-UHFFFAOYSA-N
MW272.69 g/mol
LogP3.73
Rot. Bonds2

About N-(6-chloroquinolin-8-yl)furan-2-carboxamide

N-(6-chloroquinolin-8-yl)furan-2-carboxamide (PubChem CID 60729929) has the molecular formula C14H9ClN2O2 and a molecular weight of 272.69 g/mol. Its IUPAC name is N-(6-chloroquinolin-8-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(6-chloroquinolin-8-yl)furan-2-carboxamide
PubChem CID60729929
Molecular FormulaC14H9ClN2O2
Molecular Weight272.69 g/mol
Exact Mass272.04
IUPAC NameN-(6-chloroquinolin-8-yl)furan-2-carboxamide
SMILESO=C(Nc1cc(Cl)cc2cccnc12)c1ccco1
InChIInChI=1S/C14H9ClN2O2/c15-10-7-9-3-1-5-16-13(9)11(8-10)17-14(18)12-4-2-6-19-12/h1-8H,(H,17,18)
InChIKeyVBAFLCSDFZUHHY-UHFFFAOYSA-N
XLogP3.73
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.69
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6-chloroquinolin-8-yl)furan-2-carboxamide?
The IUPAC name of N-(6-chloroquinolin-8-yl)furan-2-carboxamide (CID 60729929) is N-(6-chloroquinolin-8-yl)furan-2-carboxamide.
What is the SMILES notation for N-(6-chloroquinolin-8-yl)furan-2-carboxamide?
The canonical SMILES for N-(6-chloroquinolin-8-yl)furan-2-carboxamide is O=C(Nc1cc(Cl)cc2cccnc12)c1ccco1.
What is the InChIKey of N-(6-chloroquinolin-8-yl)furan-2-carboxamide?
The InChIKey is VBAFLCSDFZUHHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClN2O2/c15-10-7-9-3-1-5-16-13(9)11(8-10)17-14(18)12-4-2-6-19-12/h1-8H,(H,17,18).
What are the key properties of N-(6-chloroquinolin-8-yl)furan-2-carboxamide?
N-(6-chloroquinolin-8-yl)furan-2-carboxamide has a molecular weight of 272.69 g/mol, XLogP of 3.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloroquinolin-8-yl)furan-2-carboxamide is sourced from PubChem (CID 60729929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).