6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine

C23H22FN3O — CID 66955676

IUPAC6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine
SMILESCN1CCCc2c1nc(Cc1cccc(OCF)c1)c1[nH]c3ccccc3c21
InChIInChI=1S/C23H22FN3O/c1-27-11-5-9-18-21-17-8-2-3-10-19(17)25-22(21)20(26-23(18)27)13-15-6-4-7-16(12-15)28-14-24/h2-4,6-8,10,12,25H,5,9,11,13-14H2,1H3
InChIKeyQCCNNXNCJUTYMA-UHFFFAOYSA-N
MW375.45 g/mol
LogP5.00
Rot. Bonds4

About 6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine

6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine (PubChem CID 66955676) has the molecular formula C23H22FN3O and a molecular weight of 375.45 g/mol. Its IUPAC name is 6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine.

Molecular Properties

Compound Name6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine
PubChem CID66955676
Molecular FormulaC23H22FN3O
Molecular Weight375.45 g/mol
Exact Mass375.17
IUPAC Name6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine
SMILESCN1CCCc2c1nc(Cc1cccc(OCF)c1)c1[nH]c3ccccc3c21
InChIInChI=1S/C23H22FN3O/c1-27-11-5-9-18-21-17-8-2-3-10-19(17)25-22(21)20(26-23(18)27)13-15-6-4-7-16(12-15)28-14-24/h2-4,6-8,10,12,25H,5,9,11,13-14H2,1H3
InChIKeyQCCNNXNCJUTYMA-UHFFFAOYSA-N
XLogP5.00
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.45
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine?
The IUPAC name of 6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine (CID 66955676) is 6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine.
What is the SMILES notation for 6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine?
The canonical SMILES for 6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine is CN1CCCc2c1nc(Cc1cccc(OCF)c1)c1[nH]c3ccccc3c21.
What is the InChIKey of 6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine?
The InChIKey is QCCNNXNCJUTYMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22FN3O/c1-27-11-5-9-18-21-17-8-2-3-10-19(17)25-22(21)20(26-23(18)27)13-15-6-4-7-16(12-15)28-14-24/h2-4,6-8,10,12,25H,5,9,11,13-14H2,1H3.
What are the key properties of 6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine?
6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine has a molecular weight of 375.45 g/mol, XLogP of 5.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[3-(fluoromethoxy)phenyl]methyl]-4-methyl-1,2,3,7-tetrahydroindolo[2,3-c][1,8]naphthyridine is sourced from PubChem (CID 66955676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).