3-methylbenzo[i]phenazin-4-ol

C17H12N2O — CID 158641487

IUPAC3-methylbenzo[i]phenazin-4-ol
SMILESCc1ccc2nc3cc4ccccc4cc3nc2c1O
InChIInChI=1S/C17H12N2O/c1-10-6-7-13-16(17(10)20)19-15-9-12-5-3-2-4-11(12)8-14(15)18-13/h2-9,20H,1H3
InChIKeyKONRPDSBKQJZMQ-UHFFFAOYSA-N
MW260.30 g/mol
LogP3.95
Rot. Bonds

About 3-methylbenzo[i]phenazin-4-ol

3-methylbenzo[i]phenazin-4-ol (PubChem CID 158641487) has the molecular formula C17H12N2O and a molecular weight of 260.30 g/mol. Its IUPAC name is 3-methylbenzo[i]phenazin-4-ol.

Molecular Properties

Compound Name3-methylbenzo[i]phenazin-4-ol
PubChem CID158641487
Molecular FormulaC17H12N2O
Molecular Weight260.30 g/mol
Exact Mass260.09
IUPAC Name3-methylbenzo[i]phenazin-4-ol
SMILESCc1ccc2nc3cc4ccccc4cc3nc2c1O
InChIInChI=1S/C17H12N2O/c1-10-6-7-13-16(17(10)20)19-15-9-12-5-3-2-4-11(12)8-14(15)18-13/h2-9,20H,1H3
InChIKeyKONRPDSBKQJZMQ-UHFFFAOYSA-N
XLogP3.95
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

3-methylacridin-4-ol
CID 89346727
2,4-dimethylphenazin-1-ol;ethane
CID 145233565
28-methyl-31-azaheptacyclo[25.3.1.12,6.17,11.112,16.117,21.122,26]hexatriaconta-1(31),2,4,6(36),7,9,11(35),12(34),13,15,17(33),18,20,22(32),23,25,27,29-octadecaene
CID 171043793
8-methylphenazin-1-ol
CID 137287576
2-methylphenazin-1-amine
CID 19757586
1-(2-hydroxy-9,10-dimethylbenzo[a]phenazin-1-yl)-9,10-dimethylbenzo[a]phenazin-2-ol
CID 136911102
18,37-dimethyl-3,14,22,33-tetrazaheptacyclo[33.3.1.116,20.04,13.06,11.023,32.025,30]tetraconta-1(38),2,4,6,8,10,12,14,16,18,20(40),21,23,25,27,29,31,33,35(39),36-icosaene-39,40-diol
CID 135978063
phenazine-1,2,3-triol
CID 163378643
8-methoxyphenazin-1-ol
CID 138967481
quinoxalino[2,3-a]phenazin-3-yl acetate
CID 15249326
7-bromo-1-methylphenazine
CID 70908217
quinoxalino[2,3-b]phenazine-6,13-diol
CID 139171720

Frequently Asked Questions

What is the IUPAC name of 3-methylbenzo[i]phenazin-4-ol?
The IUPAC name of 3-methylbenzo[i]phenazin-4-ol (CID 158641487) is 3-methylbenzo[i]phenazin-4-ol.
What is the SMILES notation for 3-methylbenzo[i]phenazin-4-ol?
The canonical SMILES for 3-methylbenzo[i]phenazin-4-ol is Cc1ccc2nc3cc4ccccc4cc3nc2c1O.
What is the InChIKey of 3-methylbenzo[i]phenazin-4-ol?
The InChIKey is KONRPDSBKQJZMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O/c1-10-6-7-13-16(17(10)20)19-15-9-12-5-3-2-4-11(12)8-14(15)18-13/h2-9,20H,1H3.
What are the key properties of 3-methylbenzo[i]phenazin-4-ol?
3-methylbenzo[i]phenazin-4-ol has a molecular weight of 260.30 g/mol, XLogP of 3.95, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylbenzo[i]phenazin-4-ol is sourced from PubChem (CID 158641487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).