N-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide

C15H14FNO3 — CID 103600070

IUPACN-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide
SMILESO=C(NCCc1ccc(F)cc1)c1ccc(O)cc1O
InChIInChI=1S/C15H14FNO3/c16-11-3-1-10(2-4-11)7-8-17-15(20)13-6-5-12(18)9-14(13)19/h1-6,9,18-19H,7-8H2,(H,17,20)
InChIKeyXSZZIHWARGCPKA-UHFFFAOYSA-N
MW275.28 g/mol
LogP2.21
Rot. Bonds4

About N-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide

N-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide (PubChem CID 103600070) has the molecular formula C15H14FNO3 and a molecular weight of 275.28 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide
PubChem CID103600070
Molecular FormulaC15H14FNO3
Molecular Weight275.28 g/mol
Exact Mass275.10
IUPAC NameN-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide
SMILESO=C(NCCc1ccc(F)cc1)c1ccc(O)cc1O
InChIInChI=1S/C15H14FNO3/c16-11-3-1-10(2-4-11)7-8-17-15(20)13-6-5-12(18)9-14(13)19/h1-6,9,18-19H,7-8H2,(H,17,20)
InChIKeyXSZZIHWARGCPKA-UHFFFAOYSA-N
XLogP2.21
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.28
LogP ≤ 52.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dihydroxy-N-(2-phenylethyl)benzamide
CID 103600168
N-[2-(4-chlorophenyl)ethyl]-2-fluoro-4-hydroxybenzamide
CID 103939851
2-bromo-5-fluoro-N-[2-(4-fluorophenyl)ethyl]benzamide
CID 9210550
N-[2-(3,4-dihydroxyphenyl)ethyl]-2,4-difluorobenzamide
CID 78797271
2,4-dihydroxy-N-(3-iodopropyl)benzamide
CID 107726207
5-[3,5-bis[2-(4-fluorophenyl)ethylcarbamoyl]phenyl]-1-N,3-N-bis[2-(4-fluorophenyl)ethyl]benzene-1,3-dicarboxamide
CID 10605421
2,6-difluoro-N-[2-(4-hydroxyphenyl)ethyl]benzamide
CID 61017284
4-fluoro-N-[2-(4-hydroxyphenyl)ethyl]-2-(tetrazol-1-yl)benzamide
CID 29131778
5-amino-2-fluoro-N-[2-(4-hydroxyphenyl)ethyl]benzamide
CID 61238534
4-bromo-N-[2-(4-fluorophenyl)ethyl]-3-hydroxybenzamide
CID 103830357
5-fluoro-N-[2-(4-fluorophenyl)ethyl]-2-methoxybenzamide
CID 31069458
N-[2-[4-(difluoromethoxy)phenyl]ethyl]-2-hydroxy-4-methoxybenzamide
CID 27884454

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide?
The IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide (CID 103600070) is N-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide?
The canonical SMILES for N-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide is O=C(NCCc1ccc(F)cc1)c1ccc(O)cc1O.
What is the InChIKey of N-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide?
The InChIKey is XSZZIHWARGCPKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO3/c16-11-3-1-10(2-4-11)7-8-17-15(20)13-6-5-12(18)9-14(13)19/h1-6,9,18-19H,7-8H2,(H,17,20).
What are the key properties of N-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide?
N-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide has a molecular weight of 275.28 g/mol, XLogP of 2.21, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethyl]-2,4-dihydroxybenzamide is sourced from PubChem (CID 103600070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).