N-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide

C23H23NO2 — CID 11841407

IUPACN-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide
SMILESCC(O)c1cccc(NC(=O)CC(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C23H23NO2/c1-17(25)20-13-8-14-21(15-20)24-23(26)16-22(18-9-4-2-5-10-18)19-11-6-3-7-12-19/h2-15,17,22,25H,16H2,1H3,(H,24,26)
InChIKeyLLRQRPRKCYLCFX-UHFFFAOYSA-N
MW345.44 g/mol
LogP4.90
Rot. Bonds6

About N-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide

N-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide (PubChem CID 11841407) has the molecular formula C23H23NO2 and a molecular weight of 345.44 g/mol. Its IUPAC name is N-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide.

Molecular Properties

Compound NameN-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide
PubChem CID11841407
Molecular FormulaC23H23NO2
Molecular Weight345.44 g/mol
Exact Mass345.17
IUPAC NameN-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide
SMILESCC(O)c1cccc(NC(=O)CC(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C23H23NO2/c1-17(25)20-13-8-14-21(15-20)24-23(26)16-22(18-9-4-2-5-10-18)19-11-6-3-7-12-19/h2-15,17,22,25H,16H2,1H3,(H,24,26)
InChIKeyLLRQRPRKCYLCFX-UHFFFAOYSA-N
XLogP4.90
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 54.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide?
The IUPAC name of N-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide (CID 11841407) is N-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide.
What is the SMILES notation for N-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide?
The canonical SMILES for N-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide is CC(O)c1cccc(NC(=O)CC(c2ccccc2)c2ccccc2)c1.
What is the InChIKey of N-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide?
The InChIKey is LLRQRPRKCYLCFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO2/c1-17(25)20-13-8-14-21(15-20)24-23(26)16-22(18-9-4-2-5-10-18)19-11-6-3-7-12-19/h2-15,17,22,25H,16H2,1H3,(H,24,26).
What are the key properties of N-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide?
N-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide has a molecular weight of 345.44 g/mol, XLogP of 4.90, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1-hydroxyethyl)phenyl]-3,3-diphenylpropanamide is sourced from PubChem (CID 11841407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).