N-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide

C26H26N2O2 — CID 143477934

IUPACN-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide
SMILESO=C(CNC(=O)C(c1ccccc1)c1ccccc1)N[C@@H]1CCCc2ccccc21
InChIInChI=1S/C26H26N2O2/c29-24(28-23-17-9-15-19-10-7-8-16-22(19)23)18-27-26(30)25(20-11-3-1-4-12-20)21-13-5-2-6-14-21/h1-8,10-14,16,23,25H,9,15,17-18H2,(H,27,30)(H,28,29)/t23-/m1/s1
InChIKeySXCGBMJZBOODJU-HSZRJFAPSA-N
MW398.51 g/mol
LogP4.13
Rot. Bonds6

About N-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide

N-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide (PubChem CID 143477934) has the molecular formula C26H26N2O2 and a molecular weight of 398.51 g/mol. Its IUPAC name is N-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide
PubChem CID143477934
Molecular FormulaC26H26N2O2
Molecular Weight398.51 g/mol
Exact Mass398.20
IUPAC NameN-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide
SMILESO=C(CNC(=O)C(c1ccccc1)c1ccccc1)N[C@@H]1CCCc2ccccc21
InChIInChI=1S/C26H26N2O2/c29-24(28-23-17-9-15-19-10-7-8-16-22(19)23)18-27-26(30)25(20-11-3-1-4-12-20)21-13-5-2-6-14-21/h1-8,10-14,16,23,25H,9,15,17-18H2,(H,27,30)(H,28,29)/t23-/m1/s1
InChIKeySXCGBMJZBOODJU-HSZRJFAPSA-N
XLogP4.13
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.51
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide?
The IUPAC name of N-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide (CID 143477934) is N-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide?
The canonical SMILES for N-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide is O=C(CNC(=O)C(c1ccccc1)c1ccccc1)N[C@@H]1CCCc2ccccc21.
What is the InChIKey of N-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide?
The InChIKey is SXCGBMJZBOODJU-HSZRJFAPSA-N. The full InChI is InChI=1S/C26H26N2O2/c29-24(28-23-17-9-15-19-10-7-8-16-22(19)23)18-27-26(30)25(20-11-3-1-4-12-20)21-13-5-2-6-14-21/h1-8,10-14,16,23,25H,9,15,17-18H2,(H,27,30)(H,28,29)/t23-/m1/s1.
What are the key properties of N-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide?
N-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide has a molecular weight of 398.51 g/mol, XLogP of 4.13, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]-2,2-diphenylacetamide is sourced from PubChem (CID 143477934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).