2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide

C15H16FNO2 — CID 104929945

IUPAC2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide
SMILESO=C(NC1C2C3CCC(C3)C12)c1ccc(O)cc1F
InChIInChI=1S/C15H16FNO2/c16-11-6-9(18)3-4-10(11)15(19)17-14-12-7-1-2-8(5-7)13(12)14/h3-4,6-8,12-14,18H,1-2,5H2,(H,17,19)
InChIKeyZSXMSQVDCIYORO-UHFFFAOYSA-N
MW261.30 g/mol
LogP2.31
Rot. Bonds2

About 2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide

2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide (PubChem CID 104929945) has the molecular formula C15H16FNO2 and a molecular weight of 261.30 g/mol. Its IUPAC name is 2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide.

Molecular Properties

Compound Name2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide
PubChem CID104929945
Molecular FormulaC15H16FNO2
Molecular Weight261.30 g/mol
Exact Mass261.12
IUPAC Name2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide
SMILESO=C(NC1C2C3CCC(C3)C12)c1ccc(O)cc1F
InChIInChI=1S/C15H16FNO2/c16-11-6-9(18)3-4-10(11)15(19)17-14-12-7-1-2-8(5-7)13(12)14/h3-4,6-8,12-14,18H,1-2,5H2,(H,17,19)
InChIKeyZSXMSQVDCIYORO-UHFFFAOYSA-N
XLogP2.31
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

7-[2-(4-Hydroxy-benzoylamino)-6,6-dimethyl-bicyclo[3.1.1]hept-3-yl]-hept-5-enoic acid
CID 44460740
N-cyclohexyl-4-hydroxy-3-[3-(trifluoromethyl)phenyl]benzamide
CID 44534359
N-[(2S)-3-cyclohexyl-1-(cyclopropylamino)-1-oxopropan-2-yl]-4-hydroxy-3-[3-(trifluoromethyl)phenyl]benzamide
CID 44535267
N-[(2S)-2-(3-benzoylphenyl)propyl]-4-hydroxybenzamide
CID 44189777
N-[(R)-[(1R,2R)-2-butylcyclopropyl]-[2-fluoro-4-(4-hydroxyphenyl)phenyl]methyl]benzamide
CID 44592556
N-[2-(4-tert-butylphenyl)ethyl]-3-fluoro-4-hydroxybenzamide
CID 145975180
N-[2-(4-tert-butylphenyl)ethyl]-2-fluoro-4-hydroxybenzamide
CID 145976707
N-[(4-fluorophenyl)methyl]-4-hydroxybenzamide
CID 8084303
4-hydroxy-3-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 57527987
N-[2-(cyclohex-1-en-1-yl)ethyl]-4-hydroxybenzamide
CID 6472502
4-hydroxy-N-[2-(4-phenylphenyl)ethyl]benzamide
CID 145974610
4-fluoro-N-[1-(4-hydroxyphenyl)ethyl]benzamide
CID 4917412

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide?
The IUPAC name of 2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide (CID 104929945) is 2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide.
What is the SMILES notation for 2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide?
The canonical SMILES for 2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide is O=C(NC1C2C3CCC(C3)C12)c1ccc(O)cc1F.
What is the InChIKey of 2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide?
The InChIKey is ZSXMSQVDCIYORO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2/c16-11-6-9(18)3-4-10(11)15(19)17-14-12-7-1-2-8(5-7)13(12)14/h3-4,6-8,12-14,18H,1-2,5H2,(H,17,19).
What are the key properties of 2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide?
2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide has a molecular weight of 261.30 g/mol, XLogP of 2.31, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide is sourced from PubChem (CID 104929945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).