N,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine

C14H16N2O2 — CID 62201799

IUPACN,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine
SMILESCNc1c(C)c(C)nc2cc3c(cc12)OCCO3
InChIInChI=1S/C14H16N2O2/c1-8-9(2)16-11-7-13-12(17-4-5-18-13)6-10(11)14(8)15-3/h6-7H,4-5H2,1-3H3,(H,15,16)
InChIKeyZCFOWTPPWCIBEG-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.66
Rot. Bonds1

About N,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine

N,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine (PubChem CID 62201799) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is N,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine.

Molecular Properties

Compound NameN,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine
PubChem CID62201799
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC NameN,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine
SMILESCNc1c(C)c(C)nc2cc3c(cc12)OCCO3
InChIInChI=1S/C14H16N2O2/c1-8-9(2)16-11-7-13-12(17-4-5-18-13)6-10(11)14(8)15-3/h6-7H,4-5H2,1-3H3,(H,15,16)
InChIKeyZCFOWTPPWCIBEG-UHFFFAOYSA-N
XLogP2.66
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine?
The IUPAC name of N,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine (CID 62201799) is N,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine.
What is the SMILES notation for N,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine?
The canonical SMILES for N,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine is CNc1c(C)c(C)nc2cc3c(cc12)OCCO3.
What is the InChIKey of N,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine?
The InChIKey is ZCFOWTPPWCIBEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-8-9(2)16-11-7-13-12(17-4-5-18-13)6-10(11)14(8)15-3/h6-7H,4-5H2,1-3H3,(H,15,16).
What are the key properties of N,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine?
N,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine has a molecular weight of 244.29 g/mol, XLogP of 2.66, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,7,8-trimethyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-9-amine is sourced from PubChem (CID 62201799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).