2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline

C14H19FN2 — CID 112740816

IUPAC2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline
SMILESFc1cccc2c1NC(C1CCCCC1)CN2
InChIInChI=1S/C14H19FN2/c15-11-7-4-8-12-14(11)17-13(9-16-12)10-5-2-1-3-6-10/h4,7-8,10,13,16-17H,1-3,5-6,9H2
InChIKeyZLVTYFZVDSAPKC-UHFFFAOYSA-N
MW234.32 g/mol
LogP3.61
Rot. Bonds1

About 2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline

2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline (PubChem CID 112740816) has the molecular formula C14H19FN2 and a molecular weight of 234.32 g/mol. Its IUPAC name is 2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline.

Molecular Properties

Compound Name2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline
PubChem CID112740816
Molecular FormulaC14H19FN2
Molecular Weight234.32 g/mol
Exact Mass234.15
IUPAC Name2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline
SMILESFc1cccc2c1NC(C1CCCCC1)CN2
InChIInChI=1S/C14H19FN2/c15-11-7-4-8-12-14(11)17-13(9-16-12)10-5-2-1-3-6-10/h4,7-8,10,13,16-17H,1-3,5-6,9H2
InChIKeyZLVTYFZVDSAPKC-UHFFFAOYSA-N
XLogP3.61
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline?
The IUPAC name of 2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline (CID 112740816) is 2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline.
What is the SMILES notation for 2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline?
The canonical SMILES for 2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline is Fc1cccc2c1NC(C1CCCCC1)CN2.
What is the InChIKey of 2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline?
The InChIKey is ZLVTYFZVDSAPKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2/c15-11-7-4-8-12-14(11)17-13(9-16-12)10-5-2-1-3-6-10/h4,7-8,10,13,16-17H,1-3,5-6,9H2.
What are the key properties of 2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline?
2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline has a molecular weight of 234.32 g/mol, XLogP of 3.61, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-8-fluoro-1,2,3,4-tetrahydroquinoxaline is sourced from PubChem (CID 112740816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).