N-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide

C34H36N2O — CID 45034565

IUPACN-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide
SMILESCC(C)C1C(NC(=O)C(c2ccccc2)c2ccccc2)CC(c2ccccc2)NC1c1ccccc1
InChIInChI=1S/C34H36N2O/c1-24(2)31-30(36-34(37)32(26-17-9-4-10-18-26)27-19-11-5-12-20-27)23-29(25-15-7-3-8-16-25)35-33(31)28-21-13-6-14-22-28/h3-22,24,29-33,35H,23H2,1-2H3,(H,36,37)
InChIKeyZGEYPBNLKDBIDP-UHFFFAOYSA-N
MW488.68 g/mol
LogP7.05
Rot. Bonds7

About N-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide

N-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide (PubChem CID 45034565) has the molecular formula C34H36N2O and a molecular weight of 488.68 g/mol. Its IUPAC name is N-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide
PubChem CID45034565
Molecular FormulaC34H36N2O
Molecular Weight488.68 g/mol
Exact Mass488.28
IUPAC NameN-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide
SMILESCC(C)C1C(NC(=O)C(c2ccccc2)c2ccccc2)CC(c2ccccc2)NC1c1ccccc1
InChIInChI=1S/C34H36N2O/c1-24(2)31-30(36-34(37)32(26-17-9-4-10-18-26)27-19-11-5-12-20-27)23-29(25-15-7-3-8-16-25)35-33(31)28-21-13-6-14-22-28/h3-22,24,29-33,35H,23H2,1-2H3,(H,36,37)
InChIKeyZGEYPBNLKDBIDP-UHFFFAOYSA-N
XLogP7.05
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500488.68
LogP ≤ 57.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide?
The IUPAC name of N-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide (CID 45034565) is N-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide.
What is the SMILES notation for N-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide?
The canonical SMILES for N-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide is CC(C)C1C(NC(=O)C(c2ccccc2)c2ccccc2)CC(c2ccccc2)NC1c1ccccc1.
What is the InChIKey of N-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide?
The InChIKey is ZGEYPBNLKDBIDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H36N2O/c1-24(2)31-30(36-34(37)32(26-17-9-4-10-18-26)27-19-11-5-12-20-27)23-29(25-15-7-3-8-16-25)35-33(31)28-21-13-6-14-22-28/h3-22,24,29-33,35H,23H2,1-2H3,(H,36,37).
What are the key properties of N-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide?
N-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide has a molecular weight of 488.68 g/mol, XLogP of 7.05, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diphenyl-3-propan-2-ylpiperidin-4-yl)-2,2-diphenylacetamide is sourced from PubChem (CID 45034565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).