N-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide

C15H12FNO3 — CID 135065745

IUPACN-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide
SMILESO=C(NC(=O)[C@H](O)c1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C15H12FNO3/c16-12-8-6-10(7-9-12)13(18)15(20)17-14(19)11-4-2-1-3-5-11/h1-9,13,18H,(H,17,19,20)/t13-/m1/s1
InChIKeySZZJIPMQYKMKRI-CYBMUJFWSA-N
MW273.26 g/mol
LogP1.82
Rot. Bonds3

About N-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide

N-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide (PubChem CID 135065745) has the molecular formula C15H12FNO3 and a molecular weight of 273.26 g/mol. Its IUPAC name is N-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide.

Molecular Properties

Compound NameN-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide
PubChem CID135065745
Molecular FormulaC15H12FNO3
Molecular Weight273.26 g/mol
Exact Mass273.08
IUPAC NameN-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide
SMILESO=C(NC(=O)[C@H](O)c1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C15H12FNO3/c16-12-8-6-10(7-9-12)13(18)15(20)17-14(19)11-4-2-1-3-5-11/h1-9,13,18H,(H,17,19,20)/t13-/m1/s1
InChIKeySZZJIPMQYKMKRI-CYBMUJFWSA-N
XLogP1.82
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.26
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide?
The IUPAC name of N-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide (CID 135065745) is N-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide.
What is the SMILES notation for N-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide?
The canonical SMILES for N-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide is O=C(NC(=O)[C@H](O)c1ccc(F)cc1)c1ccccc1.
What is the InChIKey of N-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide?
The InChIKey is SZZJIPMQYKMKRI-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H12FNO3/c16-12-8-6-10(7-9-12)13(18)15(20)17-14(19)11-4-2-1-3-5-11/h1-9,13,18H,(H,17,19,20)/t13-/m1/s1.
What are the key properties of N-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide?
N-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide has a molecular weight of 273.26 g/mol, XLogP of 1.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(4-fluorophenyl)-2-hydroxyacetyl]benzamide is sourced from PubChem (CID 135065745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).