N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide

C25H25NO — CID 42941217

IUPACN-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide
SMILESCN(C(=O)CC(c1ccccc1)c1ccccc1)C1CCc2ccccc21
InChIInChI=1S/C25H25NO/c1-26(24-17-16-21-14-8-9-15-22(21)24)25(27)18-23(19-10-4-2-5-11-19)20-12-6-3-7-13-20/h2-15,23-24H,16-18H2,1H3
InChIKeyLGKXRHOBYXSCHQ-UHFFFAOYSA-N
MW355.48 g/mol
LogP5.35
Rot. Bonds5

About N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide

N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide (PubChem CID 42941217) has the molecular formula C25H25NO and a molecular weight of 355.48 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide
PubChem CID42941217
Molecular FormulaC25H25NO
Molecular Weight355.48 g/mol
Exact Mass355.19
IUPAC NameN-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide
SMILESCN(C(=O)CC(c1ccccc1)c1ccccc1)C1CCc2ccccc21
InChIInChI=1S/C25H25NO/c1-26(24-17-16-21-14-8-9-15-22(21)24)25(27)18-23(19-10-4-2-5-11-19)20-12-6-3-7-13-20/h2-15,23-24H,16-18H2,1H3
InChIKeyLGKXRHOBYXSCHQ-UHFFFAOYSA-N
XLogP5.35
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.48
LogP ≤ 55.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide (CID 42941217) is N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide is CN(C(=O)CC(c1ccccc1)c1ccccc1)C1CCc2ccccc21.
What is the InChIKey of N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide?
The InChIKey is LGKXRHOBYXSCHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25NO/c1-26(24-17-16-21-14-8-9-15-22(21)24)25(27)18-23(19-10-4-2-5-11-19)20-12-6-3-7-13-20/h2-15,23-24H,16-18H2,1H3.
What are the key properties of N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide?
N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide has a molecular weight of 355.48 g/mol, XLogP of 5.35, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-1-yl)-N-methyl-3,3-diphenylpropanamide is sourced from PubChem (CID 42941217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).