5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline

C16H23ClN2 — CID 134292206

IUPAC5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline
SMILESCN1CCNc2cc(C3(C)CCCCC3)cc(Cl)c21
InChIInChI=1S/C16H23ClN2/c1-16(6-4-3-5-7-16)12-10-13(17)15-14(11-12)18-8-9-19(15)2/h10-11,18H,3-9H2,1-2H3
InChIKeyUODGYMQKWIAKEN-UHFFFAOYSA-N
MW278.83 g/mol
LogP4.42
Rot. Bonds1

About 5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline

5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline (PubChem CID 134292206) has the molecular formula C16H23ClN2 and a molecular weight of 278.83 g/mol. Its IUPAC name is 5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline.

Molecular Properties

Compound Name5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline
PubChem CID134292206
Molecular FormulaC16H23ClN2
Molecular Weight278.83 g/mol
Exact Mass278.15
IUPAC Name5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline
SMILESCN1CCNc2cc(C3(C)CCCCC3)cc(Cl)c21
InChIInChI=1S/C16H23ClN2/c1-16(6-4-3-5-7-16)12-10-13(17)15-14(11-12)18-8-9-19(15)2/h10-11,18H,3-9H2,1-2H3
InChIKeyUODGYMQKWIAKEN-UHFFFAOYSA-N
XLogP4.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.83
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline?
The IUPAC name of 5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline (CID 134292206) is 5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline.
What is the SMILES notation for 5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline?
The canonical SMILES for 5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline is CN1CCNc2cc(C3(C)CCCCC3)cc(Cl)c21.
What is the InChIKey of 5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline?
The InChIKey is UODGYMQKWIAKEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23ClN2/c1-16(6-4-3-5-7-16)12-10-13(17)15-14(11-12)18-8-9-19(15)2/h10-11,18H,3-9H2,1-2H3.
What are the key properties of 5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline?
5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline has a molecular weight of 278.83 g/mol, XLogP of 4.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-methyl-7-(1-methylcyclohexyl)-2,3-dihydro-1H-quinoxaline is sourced from PubChem (CID 134292206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).