5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide

C16H15ClFNO2 — CID 155523213

IUPAC5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide
SMILESCC(C)(NC(=O)c1cc(Cl)ccc1O)c1ccc(F)cc1
InChIInChI=1S/C16H15ClFNO2/c1-16(2,10-3-6-12(18)7-4-10)19-15(21)13-9-11(17)5-8-14(13)20/h3-9,20H,1-2H3,(H,19,21)
InChIKeyURHSRHISHMSOMG-UHFFFAOYSA-N
MW307.75 g/mol
LogP3.85
Rot. Bonds3

About 5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide

5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide (PubChem CID 155523213) has the molecular formula C16H15ClFNO2 and a molecular weight of 307.75 g/mol. Its IUPAC name is 5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide.

Molecular Properties

Compound Name5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide
PubChem CID155523213
Molecular FormulaC16H15ClFNO2
Molecular Weight307.75 g/mol
Exact Mass307.08
IUPAC Name5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide
SMILESCC(C)(NC(=O)c1cc(Cl)ccc1O)c1ccc(F)cc1
InChIInChI=1S/C16H15ClFNO2/c1-16(2,10-3-6-12(18)7-4-10)19-15(21)13-9-11(17)5-8-14(13)20/h3-9,20H,1-2H3,(H,19,21)
InChIKeyURHSRHISHMSOMG-UHFFFAOYSA-N
XLogP3.85
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.75
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dichloro-N-[2-(4-fluorophenyl)propan-2-yl]benzamide
CID 110440797
5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-methoxybenzamide
CID 166667390
5-chloro-N-[1-(4-fluorophenyl)ethylideneamino]-2-hydroxybenzamide
CID 3386192
2-[4-fluoro-3-(4-fluorophenyl)phenyl]propan-2-ylcarbamic acid
CID 121483232
2-amino-N-[2-(4-bromophenyl)propan-2-yl]-4-chlorobenzamide
CID 62056776
4-bromo-N-[2-(4-bromophenyl)propan-2-yl]-2-fluorobenzamide
CID 63524757
5-chloro-N'-(3,3-difluoro-2,2-dimethylbutanoyl)-2-hydroxybenzohydrazide
CID 166235169
1-[(5-chloro-2-hydroxybenzoyl)amino]-3-(4-fluorophenyl)thiourea
CID 9096936
4-[4-[(5-chloro-2-hydroxybenzoyl)amino]-2-methylbutan-2-yl]benzenecarboperoxoic acid
CID 174527496
5-chloro-2-hydroxy-N-sulfanylbenzamide
CID 130240285
4-(5-chloro-2-hydroxyphenyl)-2-fluoro-N-(2-methylbutan-2-yl)benzamide
CID 67277408
5-chloro-N-(4-fluorophenyl)-2-hydroxy-N-methylbenzamide
CID 61063244

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide?
The IUPAC name of 5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide (CID 155523213) is 5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide.
What is the SMILES notation for 5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide?
The canonical SMILES for 5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide is CC(C)(NC(=O)c1cc(Cl)ccc1O)c1ccc(F)cc1.
What is the InChIKey of 5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide?
The InChIKey is URHSRHISHMSOMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClFNO2/c1-16(2,10-3-6-12(18)7-4-10)19-15(21)13-9-11(17)5-8-14(13)20/h3-9,20H,1-2H3,(H,19,21).
What are the key properties of 5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide?
5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide has a molecular weight of 307.75 g/mol, XLogP of 3.85, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(4-fluorophenyl)propan-2-yl]-2-hydroxybenzamide is sourced from PubChem (CID 155523213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).