N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide

C26H28N2O2 — CID 8504076

IUPACN-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide
SMILESO=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H28N2O2/c29-26(25(22-12-6-2-7-13-22)23-14-8-3-9-15-23)27-18-24-20-28(16-17-30-24)19-21-10-4-1-5-11-21/h1-15,24-25H,16-20H2,(H,27,29)/t24-/m1/s1
InChIKeyWZQGLSUGKAZFPV-XMMPIXPASA-N
MW400.52 g/mol
LogP3.84
Rot. Bonds7

About N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide

N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide (PubChem CID 8504076) has the molecular formula C26H28N2O2 and a molecular weight of 400.52 g/mol. Its IUPAC name is N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide
PubChem CID8504076
Molecular FormulaC26H28N2O2
Molecular Weight400.52 g/mol
Exact Mass400.22
IUPAC NameN-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide
SMILESO=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H28N2O2/c29-26(25(22-12-6-2-7-13-22)23-14-8-3-9-15-23)27-18-24-20-28(16-17-30-24)19-21-10-4-1-5-11-21/h1-15,24-25H,16-20H2,(H,27,29)/t24-/m1/s1
InChIKeyWZQGLSUGKAZFPV-XMMPIXPASA-N
XLogP3.84
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.52
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide?
The IUPAC name of N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide (CID 8504076) is N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide?
The canonical SMILES for N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide is O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide?
The InChIKey is WZQGLSUGKAZFPV-XMMPIXPASA-N. The full InChI is InChI=1S/C26H28N2O2/c29-26(25(22-12-6-2-7-13-22)23-14-8-3-9-15-23)27-18-24-20-28(16-17-30-24)19-21-10-4-1-5-11-21/h1-15,24-25H,16-20H2,(H,27,29)/t24-/m1/s1.
What are the key properties of N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide?
N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide has a molecular weight of 400.52 g/mol, XLogP of 3.84, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2R)-4-benzylmorpholin-2-yl]methyl]-2,2-diphenylacetamide is sourced from PubChem (CID 8504076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).