11-methylfuro[3,2-c][1,10]phenanthroline

C15H10N2O — CID 44587501

IUPAC11-methylfuro[3,2-c][1,10]phenanthroline
SMILESCc1nc2c(ccc3cccnc32)c2occc12
InChIInChI=1S/C15H10N2O/c1-9-11-6-8-18-15(11)12-5-4-10-3-2-7-16-13(10)14(12)17-9/h2-8H,1H3
InChIKeyZMRRKICFFXQQHB-UHFFFAOYSA-N
MW234.26 g/mol
LogP3.84
Rot. Bonds

About 11-methylfuro[3,2-c][1,10]phenanthroline

11-methylfuro[3,2-c][1,10]phenanthroline (PubChem CID 44587501) has the molecular formula C15H10N2O and a molecular weight of 234.26 g/mol. Its IUPAC name is 11-methylfuro[3,2-c][1,10]phenanthroline.

Molecular Properties

Compound Name11-methylfuro[3,2-c][1,10]phenanthroline
PubChem CID44587501
Molecular FormulaC15H10N2O
Molecular Weight234.26 g/mol
Exact Mass234.08
IUPAC Name11-methylfuro[3,2-c][1,10]phenanthroline
SMILESCc1nc2c(ccc3cccnc32)c2occc12
InChIInChI=1S/C15H10N2O/c1-9-11-6-8-18-15(11)12-5-4-10-3-2-7-16-13(10)14(12)17-9/h2-8H,1H3
InChIKeyZMRRKICFFXQQHB-UHFFFAOYSA-N
XLogP3.84
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 11-methylfuro[3,2-c][1,10]phenanthroline?
The IUPAC name of 11-methylfuro[3,2-c][1,10]phenanthroline (CID 44587501) is 11-methylfuro[3,2-c][1,10]phenanthroline.
What is the SMILES notation for 11-methylfuro[3,2-c][1,10]phenanthroline?
The canonical SMILES for 11-methylfuro[3,2-c][1,10]phenanthroline is Cc1nc2c(ccc3cccnc32)c2occc12.
What is the InChIKey of 11-methylfuro[3,2-c][1,10]phenanthroline?
The InChIKey is ZMRRKICFFXQQHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O/c1-9-11-6-8-18-15(11)12-5-4-10-3-2-7-16-13(10)14(12)17-9/h2-8H,1H3.
What are the key properties of 11-methylfuro[3,2-c][1,10]phenanthroline?
11-methylfuro[3,2-c][1,10]phenanthroline has a molecular weight of 234.26 g/mol, XLogP of 3.84, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methylfuro[3,2-c][1,10]phenanthroline is sourced from PubChem (CID 44587501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).