7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine

C14H16N2O3 — CID 106473119

IUPAC7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
SMILESCOc1cc2nc3c(c(N)c2cc1OC)COCC3
InChIInChI=1S/C14H16N2O3/c1-17-12-5-8-11(6-13(12)18-2)16-10-3-4-19-7-9(10)14(8)15/h5-6H,3-4,7H2,1-2H3,(H2,15,16)
InChIKeyCWBJLJBSYZOGTQ-UHFFFAOYSA-N
MW260.29 g/mol
LogP1.91
Rot. Bonds2

About 7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine

7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine (PubChem CID 106473119) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is 7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine.

Molecular Properties

Compound Name7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
PubChem CID106473119
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
SMILESCOc1cc2nc3c(c(N)c2cc1OC)COCC3
InChIInChI=1S/C14H16N2O3/c1-17-12-5-8-11(6-13(12)18-2)16-10-3-4-19-7-9(10)14(8)15/h5-6H,3-4,7H2,1-2H3,(H2,15,16)
InChIKeyCWBJLJBSYZOGTQ-UHFFFAOYSA-N
XLogP1.91
TPSA66.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The IUPAC name of 7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine (CID 106473119) is 7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine.
What is the SMILES notation for 7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The canonical SMILES for 7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine is COc1cc2nc3c(c(N)c2cc1OC)COCC3.
What is the InChIKey of 7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The InChIKey is CWBJLJBSYZOGTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-17-12-5-8-11(6-13(12)18-2)16-10-3-4-19-7-9(10)14(8)15/h5-6H,3-4,7H2,1-2H3,(H2,15,16).
What are the key properties of 7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine has a molecular weight of 260.29 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dimethoxy-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine is sourced from PubChem (CID 106473119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).