N-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide

C16H18N2O3 — CID 2206685

IUPACN-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide
SMILESO=C(CN1C(=O)C(=O)c2ccccc21)NC1CCCCC1
InChIInChI=1S/C16H18N2O3/c19-14(17-11-6-2-1-3-7-11)10-18-13-9-5-4-8-12(13)15(20)16(18)21/h4-5,8-9,11H,1-3,6-7,10H2,(H,17,19)
InChIKeyPLLQFUPUVOHKNW-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.66
Rot. Bonds3

About N-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide

N-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide (PubChem CID 2206685) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide
PubChem CID2206685
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide
SMILESO=C(CN1C(=O)C(=O)c2ccccc21)NC1CCCCC1
InChIInChI=1S/C16H18N2O3/c19-14(17-11-6-2-1-3-7-11)10-18-13-9-5-4-8-12(13)15(20)16(18)21/h4-5,8-9,11H,1-3,6-7,10H2,(H,17,19)
InChIKeyPLLQFUPUVOHKNW-UHFFFAOYSA-N
XLogP1.66
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide?
The IUPAC name of N-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide (CID 2206685) is N-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide?
The canonical SMILES for N-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide is O=C(CN1C(=O)C(=O)c2ccccc21)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide?
The InChIKey is PLLQFUPUVOHKNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c19-14(17-11-6-2-1-3-7-11)10-18-13-9-5-4-8-12(13)15(20)16(18)21/h4-5,8-9,11H,1-3,6-7,10H2,(H,17,19).
What are the key properties of N-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide?
N-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide has a molecular weight of 286.33 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(2,3-dioxoindol-1-yl)acetamide is sourced from PubChem (CID 2206685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).