1-hexyl-5,10-dihydrophenazine

C18H22N2 — CID 141276378

IUPAC1-hexyl-5,10-dihydrophenazine
SMILESCCCCCCc1cccc2c1Nc1ccccc1N2
InChIInChI=1S/C18H22N2/c1-2-3-4-5-9-14-10-8-13-17-18(14)20-16-12-7-6-11-15(16)19-17/h6-8,10-13,19-20H,2-5,9H2,1H3
InChIKeyVVUFSOCSYAOZNF-UHFFFAOYSA-N
MW266.39 g/mol
LogP5.61
Rot. Bonds5

About 1-hexyl-5,10-dihydrophenazine

1-hexyl-5,10-dihydrophenazine (PubChem CID 141276378) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 1-hexyl-5,10-dihydrophenazine.

Molecular Properties

Compound Name1-hexyl-5,10-dihydrophenazine
PubChem CID141276378
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name1-hexyl-5,10-dihydrophenazine
SMILESCCCCCCc1cccc2c1Nc1ccccc1N2
InChIInChI=1S/C18H22N2/c1-2-3-4-5-9-14-10-8-13-17-18(14)20-16-12-7-6-11-15(16)19-17/h6-8,10-13,19-20H,2-5,9H2,1H3
InChIKeyVVUFSOCSYAOZNF-UHFFFAOYSA-N
XLogP5.61
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.39
LogP ≤ 55.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-hexyl-5,10-dihydrophenazine?
The IUPAC name of 1-hexyl-5,10-dihydrophenazine (CID 141276378) is 1-hexyl-5,10-dihydrophenazine.
What is the SMILES notation for 1-hexyl-5,10-dihydrophenazine?
The canonical SMILES for 1-hexyl-5,10-dihydrophenazine is CCCCCCc1cccc2c1Nc1ccccc1N2.
What is the InChIKey of 1-hexyl-5,10-dihydrophenazine?
The InChIKey is VVUFSOCSYAOZNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-2-3-4-5-9-14-10-8-13-17-18(14)20-16-12-7-6-11-15(16)19-17/h6-8,10-13,19-20H,2-5,9H2,1H3.
What are the key properties of 1-hexyl-5,10-dihydrophenazine?
1-hexyl-5,10-dihydrophenazine has a molecular weight of 266.39 g/mol, XLogP of 5.61, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hexyl-5,10-dihydrophenazine is sourced from PubChem (CID 141276378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).