6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one

C26H18N4O2 — CID 176606687

IUPAC6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one
SMILESCc1ccnc(-n2c3ccccc3c3ccc(Oc4ccc5[nH]ccc(=O)c5n4)cc32)c1
InChIInChI=1S/C26H18N4O2/c1-16-10-12-28-24(14-16)30-21-5-3-2-4-18(21)19-7-6-17(15-22(19)30)32-25-9-8-20-26(29-25)23(31)11-13-27-20/h2-15H,1H3,(H,27,31)
InChIKeyIMFZZVIQQJGIHC-UHFFFAOYSA-N
MW418.46 g/mol
LogP5.52
Rot. Bonds3

About 6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one

6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one (PubChem CID 176606687) has the molecular formula C26H18N4O2 and a molecular weight of 418.46 g/mol. Its IUPAC name is 6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one.

Molecular Properties

Compound Name6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one
PubChem CID176606687
Molecular FormulaC26H18N4O2
Molecular Weight418.46 g/mol
Exact Mass418.14
IUPAC Name6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one
SMILESCc1ccnc(-n2c3ccccc3c3ccc(Oc4ccc5[nH]ccc(=O)c5n4)cc32)c1
InChIInChI=1S/C26H18N4O2/c1-16-10-12-28-24(14-16)30-21-5-3-2-4-18(21)19-7-6-17(15-22(19)30)32-25-9-8-20-26(29-25)23(31)11-13-27-20/h2-15H,1H3,(H,27,31)
InChIKeyIMFZZVIQQJGIHC-UHFFFAOYSA-N
XLogP5.52
TPSA72.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms32
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.46
LogP ≤ 55.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one 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-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one?
The IUPAC name of 6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one (CID 176606687) is 6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one.
What is the SMILES notation for 6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one?
The canonical SMILES for 6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one is Cc1ccnc(-n2c3ccccc3c3ccc(Oc4ccc5[nH]ccc(=O)c5n4)cc32)c1.
What is the InChIKey of 6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one?
The InChIKey is IMFZZVIQQJGIHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18N4O2/c1-16-10-12-28-24(14-16)30-21-5-3-2-4-18(21)19-7-6-17(15-22(19)30)32-25-9-8-20-26(29-25)23(31)11-13-27-20/h2-15H,1H3,(H,27,31).
What are the key properties of 6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one?
6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one has a molecular weight of 418.46 g/mol, XLogP of 5.52, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[9-(4-methyl-2-pyridinyl)carbazol-2-yl]oxy-1H-1,5-naphthyridin-4-one is sourced from PubChem (CID 176606687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).