4H-pyrano[3,2-h]quinoline

C12H9NO — CID 70280922

IUPAC4H-pyrano[3,2-h]quinoline
SMILESC1=COc2c(ccc3cccnc23)C1
InChIInChI=1S/C12H9NO/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1/h1-3,5-8H,4H2
InChIKeyPZQPGBTWTVSQGC-UHFFFAOYSA-N
MW183.21 g/mol
LogP2.68
Rot. Bonds

About 4H-pyrano[3,2-h]quinoline

4H-pyrano[3,2-h]quinoline (PubChem CID 70280922) has the molecular formula C12H9NO and a molecular weight of 183.21 g/mol. Its IUPAC name is 4H-pyrano[3,2-h]quinoline.

Molecular Properties

Compound Name4H-pyrano[3,2-h]quinoline
PubChem CID70280922
Molecular FormulaC12H9NO
Molecular Weight183.21 g/mol
Exact Mass183.07
IUPAC Name4H-pyrano[3,2-h]quinoline
SMILESC1=COc2c(ccc3cccnc23)C1
InChIInChI=1S/C12H9NO/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1/h1-3,5-8H,4H2
InChIKeyPZQPGBTWTVSQGC-UHFFFAOYSA-N
XLogP2.68
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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osmium;tris(1,10-phenanthroline)
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europium;1,10-phenanthroline
CID 20606755
bis(1,10-phenanthroline);ruthenium
CID 15001085
7H-pyrrolo[3,4-h]quinoline
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iron(2+);bis(1,10-phenanthroline);dicyanide
CID 117059127
bis(cadmium(2+));bis(chromium(6+));octakis(oxygen(2-));tetrakis(1,10-phenanthroline);dihydrate
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lead(2+);bis(1,10-phenanthroline);dinitrate
CID 139206065
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CID 172734793

Frequently Asked Questions

What is the IUPAC name of 4H-pyrano[3,2-h]quinoline?
The IUPAC name of 4H-pyrano[3,2-h]quinoline (CID 70280922) is 4H-pyrano[3,2-h]quinoline.
What is the SMILES notation for 4H-pyrano[3,2-h]quinoline?
The canonical SMILES for 4H-pyrano[3,2-h]quinoline is C1=COc2c(ccc3cccnc23)C1.
What is the InChIKey of 4H-pyrano[3,2-h]quinoline?
The InChIKey is PZQPGBTWTVSQGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9NO/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1/h1-3,5-8H,4H2.
What are the key properties of 4H-pyrano[3,2-h]quinoline?
4H-pyrano[3,2-h]quinoline has a molecular weight of 183.21 g/mol, XLogP of 2.68, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4H-pyrano[3,2-h]quinoline is sourced from PubChem (CID 70280922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).