2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide

C20H23NO2 — CID 69093023

IUPAC2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide
SMILESNC(=O)C1CCOC(CCc2ccccc2)(c2ccccc2)C1
InChIInChI=1S/C20H23NO2/c21-19(22)17-12-14-23-20(15-17,18-9-5-2-6-10-18)13-11-16-7-3-1-4-8-16/h1-10,17H,11-15H2,(H2,21,22)
InChIKeyGIVRJDRQQSFCHN-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.43
Rot. Bonds5

About 2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide

2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide (PubChem CID 69093023) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is 2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide.

Molecular Properties

Compound Name2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide
PubChem CID69093023
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Name2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide
SMILESNC(=O)C1CCOC(CCc2ccccc2)(c2ccccc2)C1
InChIInChI=1S/C20H23NO2/c21-19(22)17-12-14-23-20(15-17,18-9-5-2-6-10-18)13-11-16-7-3-1-4-8-16/h1-10,17H,11-15H2,(H2,21,22)
InChIKeyGIVRJDRQQSFCHN-UHFFFAOYSA-N
XLogP3.43
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 13895218
beta-(Aminomethyl)hydrocinnamic acid benzyl ester
CID 4192183
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(E,2S)-2-[(2R)-2-(4-fluorophenyl)-2-methoxyethyl]-N-hydroxy-6,6-diphenylhex-4-enamide
CID 59568784
4-(4-fluorophenyl)-N-hydroxy-4-phenylmethoxybutanamide
CID 59568789
(2S,4R)-2-benzyl-4-(4-fluorophenyl)-N-hydroxy-4-methoxybutanamide
CID 59568836
(2S)-2-[(2S)-2-(4-fluorophenyl)-2-methoxyethyl]-N-hydroxy-5-phenylpentanamide
CID 59568853
(2R)-2-[(2S)-2-(4-fluorophenyl)-2-methoxyethyl]-N-hydroxy-5-phenylpentanamide
CID 59568871
(E,2S)-2-[(2R)-2-(4-fluorophenyl)-2-methoxyethyl]-N-hydroxy-5-phenylpent-4-enamide
CID 59568885
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CID 59568889

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide?
The IUPAC name of 2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide (CID 69093023) is 2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide.
What is the SMILES notation for 2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide?
The canonical SMILES for 2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide is NC(=O)C1CCOC(CCc2ccccc2)(c2ccccc2)C1.
What is the InChIKey of 2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide?
The InChIKey is GIVRJDRQQSFCHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/c21-19(22)17-12-14-23-20(15-17,18-9-5-2-6-10-18)13-11-16-7-3-1-4-8-16/h1-10,17H,11-15H2,(H2,21,22).
What are the key properties of 2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide?
2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide has a molecular weight of 309.41 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-(2-phenylethyl)oxane-4-carboxamide is sourced from PubChem (CID 69093023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).