2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide

C25H26N2O2 — CID 132528728

IUPAC2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide
SMILESCC[C@]1(CC(=O)N[C@H](C)c2cccc3ccccc23)C(=O)N(C)c2ccccc21
InChIInChI=1S/C25H26N2O2/c1-4-25(21-14-7-8-15-22(21)27(3)24(25)29)16-23(28)26-17(2)19-13-9-11-18-10-5-6-12-20(18)19/h5-15,17H,4,16H2,1-3H3,(H,26,28)/t17-,25-/m1/s1
InChIKeyJTCYHJJBACXYBU-CRICUBBOSA-N
MW386.50 g/mol
LogP4.73
Rot. Bonds5

About 2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide

2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide (PubChem CID 132528728) has the molecular formula C25H26N2O2 and a molecular weight of 386.50 g/mol. Its IUPAC name is 2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide.

Molecular Properties

Compound Name2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide
PubChem CID132528728
Molecular FormulaC25H26N2O2
Molecular Weight386.50 g/mol
Exact Mass386.20
IUPAC Name2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide
SMILESCC[C@]1(CC(=O)N[C@H](C)c2cccc3ccccc23)C(=O)N(C)c2ccccc21
InChIInChI=1S/C25H26N2O2/c1-4-25(21-14-7-8-15-22(21)27(3)24(25)29)16-23(28)26-17(2)19-13-9-11-18-10-5-6-12-20(18)19/h5-15,17H,4,16H2,1-3H3,(H,26,28)/t17-,25-/m1/s1
InChIKeyJTCYHJJBACXYBU-CRICUBBOSA-N
XLogP4.73
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide?
The IUPAC name of 2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide (CID 132528728) is 2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide.
What is the SMILES notation for 2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide?
The canonical SMILES for 2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide is CC[C@]1(CC(=O)N[C@H](C)c2cccc3ccccc23)C(=O)N(C)c2ccccc21.
What is the InChIKey of 2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide?
The InChIKey is JTCYHJJBACXYBU-CRICUBBOSA-N. The full InChI is InChI=1S/C25H26N2O2/c1-4-25(21-14-7-8-15-22(21)27(3)24(25)29)16-23(28)26-17(2)19-13-9-11-18-10-5-6-12-20(18)19/h5-15,17H,4,16H2,1-3H3,(H,26,28)/t17-,25-/m1/s1.
What are the key properties of 2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide?
2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide has a molecular weight of 386.50 g/mol, XLogP of 4.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-3-ethyl-1-methyl-2-oxoindol-3-yl]-N-[(1R)-1-naphthalen-1-ylethyl]acetamide is sourced from PubChem (CID 132528728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).