2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide

C21H25NO2 — CID 110299379

IUPAC2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide
SMILESCC(Cc1ccccc1)(C(=O)NCC1CCCO1)c1ccccc1
InChIInChI=1S/C21H25NO2/c1-21(18-11-6-3-7-12-18,15-17-9-4-2-5-10-17)20(23)22-16-19-13-8-14-24-19/h2-7,9-12,19H,8,13-16H2,1H3,(H,22,23)
InChIKeyPVSROXMODQTHJU-UHFFFAOYSA-N
MW323.44 g/mol
LogP3.48
Rot. Bonds6

About 2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide

2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide (PubChem CID 110299379) has the molecular formula C21H25NO2 and a molecular weight of 323.44 g/mol. Its IUPAC name is 2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide.

Molecular Properties

Compound Name2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide
PubChem CID110299379
Molecular FormulaC21H25NO2
Molecular Weight323.44 g/mol
Exact Mass323.19
IUPAC Name2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide
SMILESCC(Cc1ccccc1)(C(=O)NCC1CCCO1)c1ccccc1
InChIInChI=1S/C21H25NO2/c1-21(18-11-6-3-7-12-18,15-17-9-4-2-5-10-17)20(23)22-16-19-13-8-14-24-19/h2-7,9-12,19H,8,13-16H2,1H3,(H,22,23)
InChIKeyPVSROXMODQTHJU-UHFFFAOYSA-N
XLogP3.48
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(oxolan-2-ylmethylcarbamoylamino)-2-phenylpropanoic acid
CID 16786304
N'-benzyl-N-(oxolan-2-ylmethyl)oxamide
CID 21211581
2-bromo-2-methyl-N-(oxolan-2-ylmethyl)propanamide
CID 82108842
N-[2-[(2-methyl-2,3-diphenylpropanoyl)amino]ethyl]benzamide
CID 110309440
2-methyl-2-(4-methylphenyl)-N-(oxolan-2-ylmethyl)propanamide
CID 113198023
1-ethyl-2-(2-hydroxy-2,3-diphenylpropyl)-3-(oxolan-2-ylmethyl)guanidine;hydroiodide
CID 111510673
2-amino-N-[4-(oxolan-2-ylmethylcarbamoylamino)phenyl]-2-phenylpropanamide;hydrochloride
CID 120587797
2-methyl-2-(oxolan-2-ylmethylamino)-3-phenylpropanenitrile
CID 114994373
N'-[[(2S)-oxolan-2-yl]methyl]-N-(2-phenylethyl)butanediamide
CID 7303399
2-(2-hydroxy-2-phenylpropyl)-1-(oxolan-2-ylmethyl)guanidine
CID 111335963
N'-benzyl-N'-methyl-N-(oxolan-2-ylmethyl)propanediamide
CID 108943617
2,2-dimethyl-N-(oxolan-2-ylmethyl)-N'-(2-propan-2-ylphenyl)propanediamide
CID 108960081

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide?
The IUPAC name of 2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide (CID 110299379) is 2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide.
What is the SMILES notation for 2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide?
The canonical SMILES for 2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide is CC(Cc1ccccc1)(C(=O)NCC1CCCO1)c1ccccc1.
What is the InChIKey of 2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide?
The InChIKey is PVSROXMODQTHJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25NO2/c1-21(18-11-6-3-7-12-18,15-17-9-4-2-5-10-17)20(23)22-16-19-13-8-14-24-19/h2-7,9-12,19H,8,13-16H2,1H3,(H,22,23).
What are the key properties of 2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide?
2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide has a molecular weight of 323.44 g/mol, XLogP of 3.48, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(oxolan-2-ylmethyl)-2,3-diphenylpropanamide is sourced from PubChem (CID 110299379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).