N-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide

C15H19N3O2 — CID 102711439

IUPACN-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide
SMILESNC1CCCCC1NC(=O)c1ccc2c(c1)NC(=O)C2
InChIInChI=1S/C15H19N3O2/c16-11-3-1-2-4-12(11)18-15(20)10-6-5-9-8-14(19)17-13(9)7-10/h5-7,11-12H,1-4,8,16H2,(H,17,19)(H,18,20)
InChIKeyVYDYFOVJNMIJDQ-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.18
Rot. Bonds2

About N-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide

N-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide (PubChem CID 102711439) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide.

Molecular Properties

Compound NameN-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide
PubChem CID102711439
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide
SMILESNC1CCCCC1NC(=O)c1ccc2c(c1)NC(=O)C2
InChIInChI=1S/C15H19N3O2/c16-11-3-1-2-4-12(11)18-15(20)10-6-5-9-8-14(19)17-13(9)7-10/h5-7,11-12H,1-4,8,16H2,(H,17,19)(H,18,20)
InChIKeyVYDYFOVJNMIJDQ-UHFFFAOYSA-N
XLogP1.18
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide?
The IUPAC name of N-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide (CID 102711439) is N-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide.
What is the SMILES notation for N-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide?
The canonical SMILES for N-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide is NC1CCCCC1NC(=O)c1ccc2c(c1)NC(=O)C2.
What is the InChIKey of N-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide?
The InChIKey is VYDYFOVJNMIJDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c16-11-3-1-2-4-12(11)18-15(20)10-6-5-9-8-14(19)17-13(9)7-10/h5-7,11-12H,1-4,8,16H2,(H,17,19)(H,18,20).
What are the key properties of N-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide?
N-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide has a molecular weight of 273.34 g/mol, XLogP of 1.18, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclohexyl)-2-oxo-1,3-dihydroindole-6-carboxamide is sourced from PubChem (CID 102711439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).