2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide

C15H21NO2 — CID 51075738

IUPAC2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide
SMILESCC(C)(C(=O)NCC1CCCO1)c1ccccc1
InChIInChI=1S/C15H21NO2/c1-15(2,12-7-4-3-5-8-12)14(17)16-11-13-9-6-10-18-13/h3-5,7-8,13H,6,9-11H2,1-2H3,(H,16,17)
InChIKeyNSBXDOVCZFNWLM-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.26
Rot. Bonds4

About 2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide

2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide (PubChem CID 51075738) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide.

Molecular Properties

Compound Name2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide
PubChem CID51075738
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide
SMILESCC(C)(C(=O)NCC1CCCO1)c1ccccc1
InChIInChI=1S/C15H21NO2/c1-15(2,12-7-4-3-5-8-12)14(17)16-11-13-9-6-10-18-13/h3-5,7-8,13H,6,9-11H2,1-2H3,(H,16,17)
InChIKeyNSBXDOVCZFNWLM-UHFFFAOYSA-N
XLogP2.26
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide?
The IUPAC name of 2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide (CID 51075738) is 2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide.
What is the SMILES notation for 2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide?
The canonical SMILES for 2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide is CC(C)(C(=O)NCC1CCCO1)c1ccccc1.
What is the InChIKey of 2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide?
The InChIKey is NSBXDOVCZFNWLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-15(2,12-7-4-3-5-8-12)14(17)16-11-13-9-6-10-18-13/h3-5,7-8,13H,6,9-11H2,1-2H3,(H,16,17).
What are the key properties of 2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide?
2-methyl-N-(oxolan-2-ylmethyl)-2-phenylpropanamide has a molecular weight of 247.34 g/mol, XLogP of 2.26, 4 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-phenylpropanamide is sourced from PubChem (CID 51075738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).