7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine

C21H14N2O — CID 164626489

IUPAC7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine
SMILESc1ccc(-c2c3c(nc4ncccc24)-c2ccccc2OC3)cc1
InChIInChI=1S/C21H14N2O/c1-2-7-14(8-3-1)19-16-10-6-12-22-21(16)23-20-15-9-4-5-11-18(15)24-13-17(19)20/h1-12H,13H2
InChIKeyNJBCBBAHHVUHAJ-UHFFFAOYSA-N
MW310.36 g/mol
LogP4.86
Rot. Bonds1

About 7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine

7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine (PubChem CID 164626489) has the molecular formula C21H14N2O and a molecular weight of 310.36 g/mol. Its IUPAC name is 7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine.

Molecular Properties

Compound Name7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine
PubChem CID164626489
Molecular FormulaC21H14N2O
Molecular Weight310.36 g/mol
Exact Mass310.11
IUPAC Name7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine
SMILESc1ccc(-c2c3c(nc4ncccc24)-c2ccccc2OC3)cc1
InChIInChI=1S/C21H14N2O/c1-2-7-14(8-3-1)19-16-10-6-12-22-21(16)23-20-15-9-4-5-11-18(15)24-13-17(19)20/h1-12H,13H2
InChIKeyNJBCBBAHHVUHAJ-UHFFFAOYSA-N
XLogP4.86
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine?
The IUPAC name of 7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine (CID 164626489) is 7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine.
What is the SMILES notation for 7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine?
The canonical SMILES for 7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine is c1ccc(-c2c3c(nc4ncccc24)-c2ccccc2OC3)cc1.
What is the InChIKey of 7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine?
The InChIKey is NJBCBBAHHVUHAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14N2O/c1-2-7-14(8-3-1)19-16-10-6-12-22-21(16)23-20-15-9-4-5-11-18(15)24-13-17(19)20/h1-12H,13H2.
What are the key properties of 7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine?
7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine has a molecular weight of 310.36 g/mol, XLogP of 4.86, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenyl-6H-chromeno[4,3-b][1,8]naphthyridine is sourced from PubChem (CID 164626489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).