10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one

C20H19N3O2 — CID 14072015

IUPAC10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one
SMILESCC(C)Oc1nccc2c1C(c1ccccc1)c1c(cc[nH]c1=O)N2
InChIInChI=1S/C20H19N3O2/c1-12(2)25-20-18-15(9-11-22-20)23-14-8-10-21-19(24)17(14)16(18)13-6-4-3-5-7-13/h3-12,16,23H,1-2H3,(H,21,24)
InChIKeyDYBNICYSPJVTOQ-UHFFFAOYSA-N
MW333.39 g/mol
LogP3.79
Rot. Bonds3

About 10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one

10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one (PubChem CID 14072015) has the molecular formula C20H19N3O2 and a molecular weight of 333.39 g/mol. Its IUPAC name is 10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one.

Molecular Properties

Compound Name10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one
PubChem CID14072015
Molecular FormulaC20H19N3O2
Molecular Weight333.39 g/mol
Exact Mass333.15
IUPAC Name10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one
SMILESCC(C)Oc1nccc2c1C(c1ccccc1)c1c(cc[nH]c1=O)N2
InChIInChI=1S/C20H19N3O2/c1-12(2)25-20-18-15(9-11-22-20)23-14-8-10-21-19(24)17(14)16(18)13-6-4-3-5-7-13/h3-12,16,23H,1-2H3,(H,21,24)
InChIKeyDYBNICYSPJVTOQ-UHFFFAOYSA-N
XLogP3.79
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one?
The IUPAC name of 10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one (CID 14072015) is 10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one.
What is the SMILES notation for 10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one?
The canonical SMILES for 10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one is CC(C)Oc1nccc2c1C(c1ccccc1)c1c(cc[nH]c1=O)N2.
What is the InChIKey of 10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one?
The InChIKey is DYBNICYSPJVTOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O2/c1-12(2)25-20-18-15(9-11-22-20)23-14-8-10-21-19(24)17(14)16(18)13-6-4-3-5-7-13/h3-12,16,23H,1-2H3,(H,21,24).
What are the key properties of 10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one?
10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one has a molecular weight of 333.39 g/mol, XLogP of 3.79, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-phenyl-1-propan-2-yloxy-8,10-dihydro-5H-pyrido[4,3-b][1,6]naphthyridin-9-one is sourced from PubChem (CID 14072015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).