6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide

C17H16N2O2 — CID 69219851

IUPAC6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide
SMILESNC(=O)c1ccc2c(c1)CC1COc3ccccc3C1N2
InChIInChI=1S/C17H16N2O2/c18-17(20)10-5-6-14-11(7-10)8-12-9-21-15-4-2-1-3-13(15)16(12)19-14/h1-7,12,16,19H,8-9H2,(H2,18,20)
InChIKeyYIQUKAZOSPCMAE-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.50
Rot. Bonds1

About 6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide

6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide (PubChem CID 69219851) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide.

Molecular Properties

Compound Name6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide
PubChem CID69219851
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide
SMILESNC(=O)c1ccc2c(c1)CC1COc3ccccc3C1N2
InChIInChI=1S/C17H16N2O2/c18-17(20)10-5-6-14-11(7-10)8-12-9-21-15-4-2-1-3-13(15)16(12)19-14/h1-7,12,16,19H,8-9H2,(H2,18,20)
InChIKeyYIQUKAZOSPCMAE-UHFFFAOYSA-N
XLogP2.50
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide?
The IUPAC name of 6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide (CID 69219851) is 6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide.
What is the SMILES notation for 6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide?
The canonical SMILES for 6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide is NC(=O)c1ccc2c(c1)CC1COc3ccccc3C1N2.
What is the InChIKey of 6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide?
The InChIKey is YIQUKAZOSPCMAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c18-17(20)10-5-6-14-11(7-10)8-12-9-21-15-4-2-1-3-13(15)16(12)19-14/h1-7,12,16,19H,8-9H2,(H2,18,20).
What are the key properties of 6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide?
6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 2.50, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline-9-carboxamide is sourced from PubChem (CID 69219851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).