ethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine

C10H16N2O2 — CID 176977794

IUPACethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine
SMILESCC.CNc1cc2c(cn1)OCCO2
InChIInChI=1S/C8H10N2O2.C2H6/c1-9-8-4-6-7(5-10-8)12-3-2-11-6;1-2/h4-5H,2-3H2,1H3,(H,9,10);1-2H3
InChIKeyCMYWVQASNLICHE-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.92
Rot. Bonds1

About ethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine

ethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine (PubChem CID 176977794) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is ethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine.

Molecular Properties

Compound Nameethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine
PubChem CID176977794
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Nameethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine
SMILESCC.CNc1cc2c(cn1)OCCO2
InChIInChI=1S/C8H10N2O2.C2H6/c1-9-8-4-6-7(5-10-8)12-3-2-11-6;1-2/h4-5H,2-3H2,1H3,(H,9,10);1-2H3
InChIKeyCMYWVQASNLICHE-UHFFFAOYSA-N
XLogP1.92
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-5-(7-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazol-3-amine
CID 116827257
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methylpyrimidin-4-amine
CID 62202609
7-(iodomethyl)-2,3-dihydro-[1,4]dioxino[2,3-c]pyridine
CID 154556737
2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-ylmethanamine;hydrochloride
CID 86346260
N-methyl-3-(7-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-1,2,4-triazin-5-amine
CID 116823927
4-cyclopropyl-N-(2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-yl)piperazine-1-carboxamide
CID 167928986
7-(1,1-difluoropropyl)-2,3-dihydro-[1,4]dioxino[2,3-c]pyridine
CID 145255303
7-(methylamino)-2,3-dihydro-[1,4]dioxino[2,3-g]quinoline-9-carbonitrile
CID 84629981
8-ethyl-3,4-dihydro-2H-[1,4]dioxepino[2,3-c]pyridine
CID 89207197
4-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-N-methylpyrimidine-2,4,6-triamine
CID 80762848
N,5-dimethylpyrazin-2-amine
CID 59693926
N-methyl-6-methylsulfanyl-2,3-dihydro-1,4-benzodioxin-7-amine
CID 130607978

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine?
The IUPAC name of ethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine (CID 176977794) is ethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine.
What is the SMILES notation for ethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine?
The canonical SMILES for ethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine is CC.CNc1cc2c(cn1)OCCO2.
What is the InChIKey of ethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine?
The InChIKey is CMYWVQASNLICHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2.C2H6/c1-9-8-4-6-7(5-10-8)12-3-2-11-6;1-2/h4-5H,2-3H2,1H3,(H,9,10);1-2H3.
What are the key properties of ethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine?
ethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine has a molecular weight of 196.25 g/mol, XLogP of 1.92, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-amine is sourced from PubChem (CID 176977794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).