N-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide

C17H23N3O2 — CID 2078434

IUPACN-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide
SMILESO=C(CN1CCc2ccccc21)NC(=O)NC1CCCCC1
InChIInChI=1S/C17H23N3O2/c21-16(19-17(22)18-14-7-2-1-3-8-14)12-20-11-10-13-6-4-5-9-15(13)20/h4-6,9,14H,1-3,7-8,10-12H2,(H2,18,19,21,22)
InChIKeyAYORRPRMNPMAEG-UHFFFAOYSA-N
MW301.39 g/mol
LogP2.21
Rot. Bonds3

About N-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide

N-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide (PubChem CID 2078434) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is N-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide
PubChem CID2078434
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC NameN-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide
SMILESO=C(CN1CCc2ccccc21)NC(=O)NC1CCCCC1
InChIInChI=1S/C17H23N3O2/c21-16(19-17(22)18-14-7-2-1-3-8-14)12-20-11-10-13-6-4-5-9-15(13)20/h4-6,9,14H,1-3,7-8,10-12H2,(H2,18,19,21,22)
InChIKeyAYORRPRMNPMAEG-UHFFFAOYSA-N
XLogP2.21
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide?
The IUPAC name of N-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide (CID 2078434) is N-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide.
What is the SMILES notation for N-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide?
The canonical SMILES for N-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide is O=C(CN1CCc2ccccc21)NC(=O)NC1CCCCC1.
What is the InChIKey of N-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide?
The InChIKey is AYORRPRMNPMAEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c21-16(19-17(22)18-14-7-2-1-3-8-14)12-20-11-10-13-6-4-5-9-15(13)20/h4-6,9,14H,1-3,7-8,10-12H2,(H2,18,19,21,22).
What are the key properties of N-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide?
N-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide has a molecular weight of 301.39 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylcarbamoyl)-2-(2,3-dihydroindol-1-yl)acetamide is sourced from PubChem (CID 2078434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).