2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide

C16H17FN2O2 — CID 125446545

IUPAC2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide
SMILESCC[C@@H](NC(=O)c1ccc(O)cc1F)c1cc(C)ccn1
InChIInChI=1S/C16H17FN2O2/c1-3-14(15-8-10(2)6-7-18-15)19-16(21)12-5-4-11(20)9-13(12)17/h4-9,14,20H,3H2,1-2H3,(H,19,21)/t14-/m1/s1
InChIKeyGJJRFWQFTLYHJX-CQSZACIVSA-N
MW288.32 g/mol
LogP3.12
Rot. Bonds4

About 2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide

2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide (PubChem CID 125446545) has the molecular formula C16H17FN2O2 and a molecular weight of 288.32 g/mol. Its IUPAC name is 2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide.

Molecular Properties

Compound Name2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide
PubChem CID125446545
Molecular FormulaC16H17FN2O2
Molecular Weight288.32 g/mol
Exact Mass288.13
IUPAC Name2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide
SMILESCC[C@@H](NC(=O)c1ccc(O)cc1F)c1cc(C)ccn1
InChIInChI=1S/C16H17FN2O2/c1-3-14(15-8-10(2)6-7-18-15)19-16(21)12-5-4-11(20)9-13(12)17/h4-9,14,20H,3H2,1-2H3,(H,19,21)/t14-/m1/s1
InChIKeyGJJRFWQFTLYHJX-CQSZACIVSA-N
XLogP3.12
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.32
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenyl)sulfanyl-N-[(1S)-1-(4-methyl-2-pyridinyl)propyl]acetamide
CID 124754655
N-(1-aminobutan-2-yl)-2-fluoro-4-hydroxybenzamide
CID 107677142
2-(2-methoxyethoxy)-N-[1-(4-methyl-2-pyridinyl)propyl]acetamide
CID 118784285
4-chloro-N-[(1R)-1-(3,4-dimethylphenyl)propyl]-2-fluorobenzamide
CID 100565359
N-(2-chloro-1-phenylethyl)-2-fluoro-4-methylbenzamide
CID 114300235
3-[(2-fluoro-4-hydroxybenzoyl)amino]-2-methylbutanoic acid
CID 107675134
2-[(2-fluoro-4-hydroxybenzoyl)amino]propanoic acid
CID 107674650
2-fluoro-4-hydroxy-N-(1-methylsulfanylpropan-2-yl)benzamide
CID 104929818
N-[1-(diethylamino)propan-2-yl]-2-fluoro-4-hydroxybenzamide
CID 104929706
2-fluoro-4-hydroxy-N-(1-hydroxy-4,4-dimethylpentan-3-yl)benzamide
CID 106353165
N-(2-bromobutyl)-2-fluoro-4-hydroxybenzamide
CID 107677727
N-(3-chloro-2-methylpropyl)-2-fluoro-4-hydroxybenzamide
CID 107677629

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide?
The IUPAC name of 2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide (CID 125446545) is 2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide.
What is the SMILES notation for 2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide?
The canonical SMILES for 2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide is CC[C@@H](NC(=O)c1ccc(O)cc1F)c1cc(C)ccn1.
What is the InChIKey of 2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide?
The InChIKey is GJJRFWQFTLYHJX-CQSZACIVSA-N. The full InChI is InChI=1S/C16H17FN2O2/c1-3-14(15-8-10(2)6-7-18-15)19-16(21)12-5-4-11(20)9-13(12)17/h4-9,14,20H,3H2,1-2H3,(H,19,21)/t14-/m1/s1.
What are the key properties of 2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide?
2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide has a molecular weight of 288.32 g/mol, XLogP of 3.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-hydroxy-N-[(1R)-1-(4-methyl-2-pyridinyl)propyl]benzamide is sourced from PubChem (CID 125446545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).