2-fluoro-4-hydroxy-N-(2-propan-2-ylcyclohexyl)benzamide

C16H22FNO2 — CID 107676775

IUPAC2-fluoro-4-hydroxy-N-(2-propan-2-ylcyclohexyl)benzamide
SMILESCC(C)C1CCCCC1NC(=O)c1ccc(O)cc1F
InChIInChI=1S/C16H22FNO2/c1-10(2)12-5-3-4-6-15(12)18-16(20)13-8-7-11(19)9-14(13)17/h7-10,12,15,19H,3-6H2,1-2H3,(H,18,20)
InChIKeyLYMADGMNLQXFET-UHFFFAOYSA-N
MW279.35 g/mol
LogP3.48
Rot. Bonds3

About 2-fluoro-4-hydroxy-N-(2-propan-2-ylcyclohexyl)benzamide

2-fluoro-4-hydroxy-N-(2-propan-2-ylcyclohexyl)benzamide (PubChem CID 107676775) has the molecular formula C16H22FNO2 and a molecular weight of 279.35 g/mol. Its IUPAC name is 2-fluoro-4-hydroxy-N-(2-propan-2-ylcyclohexyl)benzamide.

Molecular Properties

Compound Name2-fluoro-4-hydroxy-N-(2-propan-2-ylcyclohexyl)benzamide
PubChem CID107676775
Molecular FormulaC16H22FNO2
Molecular Weight279.35 g/mol
Exact Mass279.16
IUPAC Name2-fluoro-4-hydroxy-N-(2-propan-2-ylcyclohexyl)benzamide
SMILESCC(C)C1CCCCC1NC(=O)c1ccc(O)cc1F
InChIInChI=1S/C16H22FNO2/c1-10(2)12-5-3-4-6-15(12)18-16(20)13-8-7-11(19)9-14(13)17/h7-10,12,15,19H,3-6H2,1-2H3,(H,18,20)
InChIKeyLYMADGMNLQXFET-UHFFFAOYSA-N
XLogP3.48
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.35
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-N-(2-propan-2-ylcyclohexyl)-5-sulfanylbenzamide
CID 107033555
N-[1-(cyclopropylamino)-1-oxopropan-2-yl]-2-fluoro-4-hydroxybenzamide
CID 107676814
4-amino-2-chloro-N-(2-propan-2-ylcyclohexyl)benzamide;hydrochloride
CID 119775791
2,6-dihydroxy-N-(2-propan-2-ylcyclohexyl)benzamide
CID 107689521
2-fluoro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide
CID 104929945
N-[4-(ethylamino)cyclohexyl]-2-fluoro-4-hydroxybenzamide
CID 107675625
2,4-dihydroxy-N-(2-hydroxycyclohexyl)benzamide
CID 62366802
2,4-dihydroxy-N-(2-methylcycloheptyl)benzamide
CID 103714355
2-fluoro-N-(2-hydroxycyclohexyl)-4-methoxybenzamide
CID 103816699
2-fluoro-4-methyl-N-[2-(trifluoromethyl)cyclohexyl]benzamide
CID 79765205
N-(3-cyclopentylpropyl)-2-fluoro-4-hydroxybenzamide
CID 103940047
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-2-fluoro-4-hydroxybenzamide
CID 103940037

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-hydroxy-N-(2-propan-2-ylcyclohexyl)benzamide?
The IUPAC name of 2-fluoro-4-hydroxy-N-(2-propan-2-ylcyclohexyl)benzamide (CID 107676775) is 2-fluoro-4-hydroxy-N-(2-propan-2-ylcyclohexyl)benzamide.
What is the SMILES notation for 2-fluoro-4-hydroxy-N-(2-propan-2-ylcyclohexyl)benzamide?
The canonical SMILES for 2-fluoro-4-hydroxy-N-(2-propan-2-ylcyclohexyl)benzamide is CC(C)C1CCCCC1NC(=O)c1ccc(O)cc1F.
What is the InChIKey of 2-fluoro-4-hydroxy-N-(2-propan-2-ylcyclohexyl)benzamide?
The InChIKey is LYMADGMNLQXFET-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22FNO2/c1-10(2)12-5-3-4-6-15(12)18-16(20)13-8-7-11(19)9-14(13)17/h7-10,12,15,19H,3-6H2,1-2H3,(H,18,20).
What are the key properties of 2-fluoro-4-hydroxy-N-(2-propan-2-ylcyclohexyl)benzamide?
2-fluoro-4-hydroxy-N-(2-propan-2-ylcyclohexyl)benzamide has a molecular weight of 279.35 g/mol, XLogP of 3.48, 3 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-(2-propan-2-ylcyclohexyl)benzamide is sourced from PubChem (CID 107676775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).