N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane

C17H15BrN2O2 — CID 161317877

IUPACN-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane
SMILESC.O=C(Nc1ccccc1Br)c1ccc2cccnc2c1O
InChIInChI=1S/C16H11BrN2O2.CH4/c17-12-5-1-2-6-13(12)19-16(21)11-8-7-10-4-3-9-18-14(10)15(11)20;/h1-9,20H,(H,19,21);1H4
InChIKeyVJSYRFGESMLQLY-UHFFFAOYSA-N
MW359.22 g/mol
LogP4.59
Rot. Bonds2

About N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane

N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane (PubChem CID 161317877) has the molecular formula C17H15BrN2O2 and a molecular weight of 359.22 g/mol. Its IUPAC name is N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane.

Molecular Properties

Compound NameN-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane
PubChem CID161317877
Molecular FormulaC17H15BrN2O2
Molecular Weight359.22 g/mol
Exact Mass358.03
IUPAC NameN-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane
SMILESC.O=C(Nc1ccccc1Br)c1ccc2cccnc2c1O
InChIInChI=1S/C16H11BrN2O2.CH4/c17-12-5-1-2-6-13(12)19-16(21)11-8-7-10-4-3-9-18-14(10)15(11)20;/h1-9,20H,(H,19,21);1H4
InChIKeyVJSYRFGESMLQLY-UHFFFAOYSA-N
XLogP4.59
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.22
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromophenyl)quinoline-8-carboxamide
CID 60651885
N-(5-fluoro-2-methylphenyl)-8-hydroxyquinoline-7-carboxamide
CID 18372561
N-(2-bromophenyl)-2-(quinolin-8-ylamino)acetamide
CID 109010779
2-amino-3-bromo-N-quinolin-8-ylbenzamide
CID 110451344
2-bromo-6-hydroxy-N-quinolin-8-ylbenzamide
CID 174610823
N-[2-(4-bromophenyl)ethyl]-8-hydroxyquinoline-7-carboxamide;methane
CID 159643443
3-fluoro-2-hydroxy-N-quinolin-8-ylbenzamide
CID 46846762
8-hydroxy-N-(pyridin-2-ylmethyl)quinoline-7-carboxamide
CID 53302604
N-(9,10-dihydroanthracen-2-yl)-8-hydroxyquinoline-7-carboxamide
CID 20700238
N-(4-cyano-2-fluorophenyl)-8-hydroxyquinoline-7-carboxamide
CID 155523733
N-(2-bromophenyl)-2-methoxypyridine-3-carboxamide
CID 55023834
N-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride
CID 18372701

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane?
The IUPAC name of N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane (CID 161317877) is N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane.
What is the SMILES notation for N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane?
The canonical SMILES for N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane is C.O=C(Nc1ccccc1Br)c1ccc2cccnc2c1O.
What is the InChIKey of N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane?
The InChIKey is VJSYRFGESMLQLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11BrN2O2.CH4/c17-12-5-1-2-6-13(12)19-16(21)11-8-7-10-4-3-9-18-14(10)15(11)20;/h1-9,20H,(H,19,21);1H4.
What are the key properties of N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane?
N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane has a molecular weight of 359.22 g/mol, XLogP of 4.59, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane is sourced from PubChem (CID 161317877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).