N-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide

C25H27NO2 — CID 26747

IUPACN-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide
SMILESCCN(C(C)=O)C(CC(O)(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C25H27NO2/c1-3-26(20(2)27)24(21-13-7-4-8-14-21)19-25(28,22-15-9-5-10-16-22)23-17-11-6-12-18-23/h4-18,24,28H,3,19H2,1-2H3
InChIKeyIWVHEAPNZYLYDY-UHFFFAOYSA-N
MW373.50 g/mol
LogP4.92
Rot. Bonds7

About N-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide

N-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide (PubChem CID 26747) has the molecular formula C25H27NO2 and a molecular weight of 373.50 g/mol. Its IUPAC name is N-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide.

Molecular Properties

Compound NameN-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide
PubChem CID26747
Molecular FormulaC25H27NO2
Molecular Weight373.50 g/mol
Exact Mass373.20
IUPAC NameN-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide
SMILESCCN(C(C)=O)C(CC(O)(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C25H27NO2/c1-3-26(20(2)27)24(21-13-7-4-8-14-21)19-25(28,22-15-9-5-10-16-22)23-17-11-6-12-18-23/h4-18,24,28H,3,19H2,1-2H3
InChIKeyIWVHEAPNZYLYDY-UHFFFAOYSA-N
XLogP4.92
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.50
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide?
The IUPAC name of N-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide (CID 26747) is N-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide.
What is the SMILES notation for N-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide?
The canonical SMILES for N-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide is CCN(C(C)=O)C(CC(O)(c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of N-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide?
The InChIKey is IWVHEAPNZYLYDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27NO2/c1-3-26(20(2)27)24(21-13-7-4-8-14-21)19-25(28,22-15-9-5-10-16-22)23-17-11-6-12-18-23/h4-18,24,28H,3,19H2,1-2H3.
What are the key properties of N-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide?
N-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide has a molecular weight of 373.50 g/mol, XLogP of 4.92, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-hydroxy-1,3,3-triphenylpropyl)acetamide is sourced from PubChem (CID 26747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).