N-(oxan-2-yl)benzamide

C12H15NO2 — CID 3717262

IUPACN-(oxan-2-yl)benzamide
SMILESO=C(NC1CCCCO1)c1ccccc1
InChIInChI=1S/C12H15NO2/c14-12(10-6-2-1-3-7-10)13-11-8-4-5-9-15-11/h1-3,6-7,11H,4-5,8-9H2,(H,13,14)
InChIKeyACJOIWBNYDPODS-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.94
Rot. Bonds2

About N-(oxan-2-yl)benzamide

N-(oxan-2-yl)benzamide (PubChem CID 3717262) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is N-(oxan-2-yl)benzamide.

Molecular Properties

Compound NameN-(oxan-2-yl)benzamide
PubChem CID3717262
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC NameN-(oxan-2-yl)benzamide
SMILESO=C(NC1CCCCO1)c1ccccc1
InChIInChI=1S/C12H15NO2/c14-12(10-6-2-1-3-7-10)13-11-8-4-5-9-15-11/h1-3,6-7,11H,4-5,8-9H2,(H,13,14)
InChIKeyACJOIWBNYDPODS-UHFFFAOYSA-N
XLogP1.94
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-benzamidocyclobutyl)benzamide
CID 58037122
1-benzhydryl-3-(oxolan-2-yl)urea
CID 108887792
N-[(1R)-2-methylcyclohexyl]benzamide
CID 137472316
N-[(1S,2R)-2-aminocyclohexyl]benzamide
CID 15151854
N-[(1S,2S)-2-aminocyclohexyl]benzamide
CID 15151853
CID 162397475
CID 162397475
N-[(1R,2R)-2-hydroxycyclopentyl]benzamide
CID 36691439
N-(3-oxooxazinan-4-yl)benzamide
CID 22561655
N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 85447885
N-(4-cyclohexylcyclooctyl)benzamide
CID 166761299
N-(5-aminomorpholin-2-yl)benzamide
CID 150839194
N-[(2R,5S)-2-[[(2S,5R)-5-benzamido-1,3-dioxepan-2-yl]methyl]-1,3-dioxepan-5-yl]benzamide
CID 10837431

Frequently Asked Questions

What is the IUPAC name of N-(oxan-2-yl)benzamide?
The IUPAC name of N-(oxan-2-yl)benzamide (CID 3717262) is N-(oxan-2-yl)benzamide.
What is the SMILES notation for N-(oxan-2-yl)benzamide?
The canonical SMILES for N-(oxan-2-yl)benzamide is O=C(NC1CCCCO1)c1ccccc1.
What is the InChIKey of N-(oxan-2-yl)benzamide?
The InChIKey is ACJOIWBNYDPODS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c14-12(10-6-2-1-3-7-10)13-11-8-4-5-9-15-11/h1-3,6-7,11H,4-5,8-9H2,(H,13,14).
What are the key properties of N-(oxan-2-yl)benzamide?
N-(oxan-2-yl)benzamide has a molecular weight of 205.26 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxan-2-yl)benzamide is sourced from PubChem (CID 3717262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).