N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide

C18H19NO4 — CID 91794686

IUPACN-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide
SMILESO=C(N[C@@H]1CCOC[C@H]1O)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C18H19NO4/c20-17-12-22-10-9-16(17)19-18(21)13-5-4-8-15(11-13)23-14-6-2-1-3-7-14/h1-8,11,16-17,20H,9-10,12H2,(H,19,21)/t16-,17-/m1/s1
InChIKeyLOSXNJAHIAXTOK-IAGOWNOFSA-N
MW313.35 g/mol
LogP2.36
Rot. Bonds4

About N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide

N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide (PubChem CID 91794686) has the molecular formula C18H19NO4 and a molecular weight of 313.35 g/mol. Its IUPAC name is N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide.

Molecular Properties

Compound NameN-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide
PubChem CID91794686
Molecular FormulaC18H19NO4
Molecular Weight313.35 g/mol
Exact Mass313.13
IUPAC NameN-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide
SMILESO=C(N[C@@H]1CCOC[C@H]1O)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C18H19NO4/c20-17-12-22-10-9-16(17)19-18(21)13-5-4-8-15(11-13)23-14-6-2-1-3-7-14/h1-8,11,16-17,20H,9-10,12H2,(H,19,21)/t16-,17-/m1/s1
InChIKeyLOSXNJAHIAXTOK-IAGOWNOFSA-N
XLogP2.36
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.35
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopentyl-3-phenoxybenzamide
CID 2684460
3-phenoxy-N-piperidin-4-ylbenzamide
CID 71730778
N-cyclopropyl-3-[(3-phenoxybenzoyl)amino]benzamide
CID 9438583
(2S,4S)-5-oxo-4-[(3-phenoxybenzoyl)amino]pyrrolidine-2-carboxylic acid
CID 102273254
3-(difluoromethoxy)-N-[(3S,4R)-3-(3-methylbut-2-enoxy)oxan-4-yl]benzamide
CID 91776698
3-cyano-N-[(3R,4R)-4-(4-cyanophenoxy)oxan-3-yl]benzamide
CID 91768615
N-[[(3R)-1,1-dioxothiolan-3-yl]carbamoyl]-3-phenoxybenzamide
CID 51417817
N-[(3S,4S)-4-acetyloxan-3-yl]benzamide;sulfane
CID 160553330
N-[1-(hydroxymethyl)-4-tricyclo[5.3.1.03,9]undecanyl]-3-phenoxybenzamide
CID 71070702
3-(2-ethoxyethoxy)-N-[(3S,4R)-3-methoxyoxan-4-yl]benzamide
CID 91761869
N-[(3S)-3-(cyclopropanecarbonylamino)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]-3-pyridin-3-yloxybenzamide
CID 70968785
3-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 4842813

Frequently Asked Questions

What is the IUPAC name of N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide?
The IUPAC name of N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide (CID 91794686) is N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide.
What is the SMILES notation for N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide?
The canonical SMILES for N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide is O=C(N[C@@H]1CCOC[C@H]1O)c1cccc(Oc2ccccc2)c1.
What is the InChIKey of N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide?
The InChIKey is LOSXNJAHIAXTOK-IAGOWNOFSA-N. The full InChI is InChI=1S/C18H19NO4/c20-17-12-22-10-9-16(17)19-18(21)13-5-4-8-15(11-13)23-14-6-2-1-3-7-14/h1-8,11,16-17,20H,9-10,12H2,(H,19,21)/t16-,17-/m1/s1.
What are the key properties of N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide?
N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide has a molecular weight of 313.35 g/mol, XLogP of 2.36, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-phenoxybenzamide is sourced from PubChem (CID 91794686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).