N-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane

C18H16Cl2N2O2 — CID 159727206

IUPACN-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane
SMILESC.O=C(NCc1ccc(Cl)cc1Cl)c1ccc2cccnc2c1O
InChIInChI=1S/C17H12Cl2N2O2.CH4/c18-12-5-3-11(14(19)8-12)9-21-17(23)13-6-4-10-2-1-7-20-15(10)16(13)22;/h1-8,22H,9H2,(H,21,23);1H4
InChIKeyNAUBHFBOIAKZKQ-UHFFFAOYSA-N
MW363.24 g/mol
LogP4.81
Rot. Bonds3

About N-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane

N-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane (PubChem CID 159727206) has the molecular formula C18H16Cl2N2O2 and a molecular weight of 363.24 g/mol. Its IUPAC name is N-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane.

Molecular Properties

Compound NameN-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane
PubChem CID159727206
Molecular FormulaC18H16Cl2N2O2
Molecular Weight363.24 g/mol
Exact Mass362.06
IUPAC NameN-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane
SMILESC.O=C(NCc1ccc(Cl)cc1Cl)c1ccc2cccnc2c1O
InChIInChI=1S/C17H12Cl2N2O2.CH4/c18-12-5-3-11(14(19)8-12)9-21-17(23)13-6-4-10-2-1-7-20-15(10)16(13)22;/h1-8,22H,9H2,(H,21,23);1H4
InChIKeyNAUBHFBOIAKZKQ-UHFFFAOYSA-N
XLogP4.81
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.24
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-chlorophenyl)ethyl]-8-hydroxyquinoline-7-carboxamide
CID 18372521
8-hydroxy-N-(pyridin-2-ylmethyl)quinoline-7-carboxamide
CID 53302604
(4-chlorophenyl)methanamine;N-[(4-chlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;8-hydroxyquinoline-7-carboxylic acid
CID 159537945
N-[(2,4-dichlorophenyl)methyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide
CID 9403592
5-chloro-N-[(4-chlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide
CID 18372562
N-[(2,4-dichlorophenyl)methyl]quinoline-2-carboxamide
CID 2707271
3-chloro-N-[(2,4-dichlorophenyl)methyl]pyridazine-4-carboxamide
CID 22992257
8-hydroxy-N-[(4-hydroxy-3-methoxyphenyl)methyl]quinoline-7-carboxamide
CID 18372541
N-[(2-hydroxyphenyl)methyl]quinoline-8-carboxamide
CID 115598832
N-[(2,4-dichlorophenyl)methyl]-2,4,5-trimethylbenzamide
CID 100708024
N-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride
CID 18372701
N-[(2-chlorophenyl)methyl]-2-quinolin-8-ylacetamide
CID 51307001

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane?
The IUPAC name of N-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane (CID 159727206) is N-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane.
What is the SMILES notation for N-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane?
The canonical SMILES for N-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane is C.O=C(NCc1ccc(Cl)cc1Cl)c1ccc2cccnc2c1O.
What is the InChIKey of N-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane?
The InChIKey is NAUBHFBOIAKZKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12Cl2N2O2.CH4/c18-12-5-3-11(14(19)8-12)9-21-17(23)13-6-4-10-2-1-7-20-15(10)16(13)22;/h1-8,22H,9H2,(H,21,23);1H4.
What are the key properties of N-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane?
N-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane has a molecular weight of 363.24 g/mol, XLogP of 4.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dichlorophenyl)methyl]-8-hydroxyquinoline-7-carboxamide;methane is sourced from PubChem (CID 159727206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).