5-pentyl-2,10-dihydro-1H-phenazine

C17H22N2 — CID 70231574

IUPAC5-pentyl-2,10-dihydro-1H-phenazine
SMILESCCCCCN1C2=C(CCC=C2)Nc2ccccc21
InChIInChI=1S/C17H22N2/c1-2-3-8-13-19-16-11-6-4-9-14(16)18-15-10-5-7-12-17(15)19/h4,6-7,9,11-12,18H,2-3,5,8,10,13H2,1H3
InChIKeyMRFVTZOIKGQNPN-UHFFFAOYSA-N
MW254.38 g/mol
LogP4.67
Rot. Bonds4

About 5-pentyl-2,10-dihydro-1H-phenazine

5-pentyl-2,10-dihydro-1H-phenazine (PubChem CID 70231574) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is 5-pentyl-2,10-dihydro-1H-phenazine.

Molecular Properties

Compound Name5-pentyl-2,10-dihydro-1H-phenazine
PubChem CID70231574
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name5-pentyl-2,10-dihydro-1H-phenazine
SMILESCCCCCN1C2=C(CCC=C2)Nc2ccccc21
InChIInChI=1S/C17H22N2/c1-2-3-8-13-19-16-11-6-4-9-14(16)18-15-10-5-7-12-17(15)19/h4,6-7,9,11-12,18H,2-3,5,8,10,13H2,1H3
InChIKeyMRFVTZOIKGQNPN-UHFFFAOYSA-N
XLogP4.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-pentyl-2,10-dihydro-1H-phenazine?
The IUPAC name of 5-pentyl-2,10-dihydro-1H-phenazine (CID 70231574) is 5-pentyl-2,10-dihydro-1H-phenazine.
What is the SMILES notation for 5-pentyl-2,10-dihydro-1H-phenazine?
The canonical SMILES for 5-pentyl-2,10-dihydro-1H-phenazine is CCCCCN1C2=C(CCC=C2)Nc2ccccc21.
What is the InChIKey of 5-pentyl-2,10-dihydro-1H-phenazine?
The InChIKey is MRFVTZOIKGQNPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-2-3-8-13-19-16-11-6-4-9-14(16)18-15-10-5-7-12-17(15)19/h4,6-7,9,11-12,18H,2-3,5,8,10,13H2,1H3.
What are the key properties of 5-pentyl-2,10-dihydro-1H-phenazine?
5-pentyl-2,10-dihydro-1H-phenazine has a molecular weight of 254.38 g/mol, XLogP of 4.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pentyl-2,10-dihydro-1H-phenazine is sourced from PubChem (CID 70231574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).