N-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide

C20H14ClF2NO3 — CID 167778996

IUPACN-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide
SMILESO=C(NC(c1cc(F)ccc1F)c1ccccc1Cl)c1ccc(O)cc1O
InChIInChI=1S/C20H14ClF2NO3/c21-16-4-2-1-3-13(16)19(15-9-11(22)5-8-17(15)23)24-20(27)14-7-6-12(25)10-18(14)26/h1-10,19,25-26H,(H,24,27)
InChIKeyOPBAXBKZNXLINT-UHFFFAOYSA-N
MW389.79 g/mol
LogP4.55
Rot. Bonds4

About N-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide

N-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide (PubChem CID 167778996) has the molecular formula C20H14ClF2NO3 and a molecular weight of 389.79 g/mol. Its IUPAC name is N-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide
PubChem CID167778996
Molecular FormulaC20H14ClF2NO3
Molecular Weight389.79 g/mol
Exact Mass389.06
IUPAC NameN-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide
SMILESO=C(NC(c1cc(F)ccc1F)c1ccccc1Cl)c1ccc(O)cc1O
InChIInChI=1S/C20H14ClF2NO3/c21-16-4-2-1-3-13(16)19(15-9-11(22)5-8-17(15)23)24-20(27)14-7-6-12(25)10-18(14)26/h1-10,19,25-26H,(H,24,27)
InChIKeyOPBAXBKZNXLINT-UHFFFAOYSA-N
XLogP4.55
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.79
LogP ≤ 54.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-chlorophenyl)ethyl]-2,4-dihydroxybenzamide
CID 103600135
N-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]pyrrolidine-3-carboxamide
CID 119806108
3-amino-N-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]cyclopentane-1-carboxamide;hydrochloride
CID 119806095
N-[1-(2-chlorophenyl)ethyl]-5-fluoro-2-hydroxybenzamide
CID 115298970
4-fluoro-2-hydroxy-N-(2,4,6-trichlorophenyl)benzamide
CID 107015128
2-chloro-N-[1-(2,5-difluorophenyl)ethyl]-4-fluorobenzamide
CID 46591256
2-chloro-N-[1-(2-chlorophenyl)ethyl]-5-hydroxybenzamide
CID 106501562
4-fluoro-2-hydroxy-N-[1-(2-methylphenyl)ethyl]benzamide
CID 107015172
N-benzhydryl-2-bromo-4-fluorobenzamide
CID 9192491
1-(2-chlorophenyl)-3-(2,4-dihydroxyphenyl)propane-1,3-dione
CID 52916523
3-chloro-2-[(4-fluoro-2-hydroxybenzoyl)amino]benzoic acid
CID 107046351
N-(2-chloro-6-methylphenyl)-4-fluoro-2-hydroxybenzamide
CID 103889268

Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide?
The IUPAC name of N-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide (CID 167778996) is N-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide.
What is the SMILES notation for N-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide?
The canonical SMILES for N-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide is O=C(NC(c1cc(F)ccc1F)c1ccccc1Cl)c1ccc(O)cc1O.
What is the InChIKey of N-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide?
The InChIKey is OPBAXBKZNXLINT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14ClF2NO3/c21-16-4-2-1-3-13(16)19(15-9-11(22)5-8-17(15)23)24-20(27)14-7-6-12(25)10-18(14)26/h1-10,19,25-26H,(H,24,27).
What are the key properties of N-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide?
N-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide has a molecular weight of 389.79 g/mol, XLogP of 4.55, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)-(2,5-difluorophenyl)methyl]-2,4-dihydroxybenzamide is sourced from PubChem (CID 167778996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).