2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide

C12H10N2O3 — CID 67383465

IUPAC2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide
SMILESNC(=O)c1ccnc2cc3c(cc12)OCCO3
InChIInChI=1S/C12H10N2O3/c13-12(15)7-1-2-14-9-6-11-10(5-8(7)9)16-3-4-17-11/h1-2,5-6H,3-4H2,(H2,13,15)
InChIKeyTULZEEAZJOUHOO-UHFFFAOYSA-N
MW230.22 g/mol
LogP1.10
Rot. Bonds1

About 2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide

2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide (PubChem CID 67383465) has the molecular formula C12H10N2O3 and a molecular weight of 230.22 g/mol. Its IUPAC name is 2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide.

Molecular Properties

Compound Name2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide
PubChem CID67383465
Molecular FormulaC12H10N2O3
Molecular Weight230.22 g/mol
Exact Mass230.07
IUPAC Name2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide
SMILESNC(=O)c1ccnc2cc3c(cc12)OCCO3
InChIInChI=1S/C12H10N2O3/c13-12(15)7-1-2-14-9-6-11-10(5-8(7)9)16-3-4-17-11/h1-2,5-6H,3-4H2,(H2,13,15)
InChIKeyTULZEEAZJOUHOO-UHFFFAOYSA-N
XLogP1.10
TPSA74.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.22
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide?
The IUPAC name of 2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide (CID 67383465) is 2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide.
What is the SMILES notation for 2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide?
The canonical SMILES for 2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide is NC(=O)c1ccnc2cc3c(cc12)OCCO3.
What is the InChIKey of 2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide?
The InChIKey is TULZEEAZJOUHOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O3/c13-12(15)7-1-2-14-9-6-11-10(5-8(7)9)16-3-4-17-11/h1-2,5-6H,3-4H2,(H2,13,15).
What are the key properties of 2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide?
2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide has a molecular weight of 230.22 g/mol, XLogP of 1.10, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carboxamide is sourced from PubChem (CID 67383465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).