4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide

C17H18FNO3 — CID 131907534

IUPAC4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide
SMILESCOCC(O)CNC(=O)c1ccc(-c2cccc(F)c2)cc1
InChIInChI=1S/C17H18FNO3/c1-22-11-16(20)10-19-17(21)13-7-5-12(6-8-13)14-3-2-4-15(18)9-14/h2-9,16,20H,10-11H2,1H3,(H,19,21)
InChIKeySLTXJMVDIWPSGM-UHFFFAOYSA-N
MW303.33 g/mol
LogP2.23
Rot. Bonds6

About 4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide

4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide (PubChem CID 131907534) has the molecular formula C17H18FNO3 and a molecular weight of 303.33 g/mol. Its IUPAC name is 4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide.

Molecular Properties

Compound Name4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide
PubChem CID131907534
Molecular FormulaC17H18FNO3
Molecular Weight303.33 g/mol
Exact Mass303.13
IUPAC Name4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide
SMILESCOCC(O)CNC(=O)c1ccc(-c2cccc(F)c2)cc1
InChIInChI=1S/C17H18FNO3/c1-22-11-16(20)10-19-17(21)13-7-5-12(6-8-13)14-3-2-4-15(18)9-14/h2-9,16,20H,10-11H2,1H3,(H,19,21)
InChIKeySLTXJMVDIWPSGM-UHFFFAOYSA-N
XLogP2.23
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.33
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxy-3-methoxypropyl)-4-sulfanylbenzamide
CID 107030584
1-(3-fluoroanilino)-3-methoxypropan-2-ol
CID 63928582
N-(2-hydroxy-3-methoxypropyl)-5-iodothiophene-3-carboxamide
CID 79693699
6-fluoro-N-(2-hydroxy-3-methoxypropyl)-1-benzothiophene-2-carboxamide
CID 81104803
N-(2-hydroxypropyl)-4-phenylbenzamide
CID 43391038
4-(3-fluorophenyl)-N-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]benzamide
CID 77078604
1-N,4-N-bis[2-(3-fluorophenoxy)ethyl]benzene-1,4-dicarboxamide
CID 166196673
N-(2-methylpropyl)-4-(4-phenylphenyl)benzamide
CID 145125410
N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-4-methylbenzamide
CID 51186635
2-(aminomethyl)-N-(2-hydroxy-3-methoxypropyl)pyridine-4-carboxamide
CID 113277862
N-(3-amino-4-methoxybutyl)-3-fluorobenzamide
CID 106243471
N-[(2R)-3-(3-fluorophenoxy)-2-hydroxypropyl]-1-oxidopyridin-1-ium-3-carboxamide
CID 94654315

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide?
The IUPAC name of 4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide (CID 131907534) is 4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide.
What is the SMILES notation for 4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide?
The canonical SMILES for 4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide is COCC(O)CNC(=O)c1ccc(-c2cccc(F)c2)cc1.
What is the InChIKey of 4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide?
The InChIKey is SLTXJMVDIWPSGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO3/c1-22-11-16(20)10-19-17(21)13-7-5-12(6-8-13)14-3-2-4-15(18)9-14/h2-9,16,20H,10-11H2,1H3,(H,19,21).
What are the key properties of 4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide?
4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide has a molecular weight of 303.33 g/mol, XLogP of 2.23, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluorophenyl)-N-(2-hydroxy-3-methoxypropyl)benzamide is sourced from PubChem (CID 131907534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).