6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine

C12H15NO3 — CID 64661825

IUPAC6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine
SMILESCCC1Oc2cc3c(cc2C1NC)OCO3
InChIInChI=1S/C12H15NO3/c1-3-8-12(13-2)7-4-10-11(15-6-14-10)5-9(7)16-8/h4-5,8,12-13H,3,6H2,1-2H3
InChIKeyWZOPHZFMGMMTJG-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.85
Rot. Bonds2

About 6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine

6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine (PubChem CID 64661825) has the molecular formula C12H15NO3 and a molecular weight of 221.26 g/mol. Its IUPAC name is 6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine.

Molecular Properties

Compound Name6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine
PubChem CID64661825
Molecular FormulaC12H15NO3
Molecular Weight221.26 g/mol
Exact Mass221.11
IUPAC Name6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine
SMILESCCC1Oc2cc3c(cc2C1NC)OCO3
InChIInChI=1S/C12H15NO3/c1-3-8-12(13-2)7-4-10-11(15-6-14-10)5-9(7)16-8/h4-5,8,12-13H,3,6H2,1-2H3
InChIKeyWZOPHZFMGMMTJG-UHFFFAOYSA-N
XLogP1.85
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine
CID 83050298
2-ethyl-N-methyl-5-(2,4,4-trimethylpentan-2-yl)-2,3-dihydro-1-benzofuran-3-amine
CID 64661216
5-bromo-6-fluoro-N-methyl-2-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 83049038
6-bromo-N-methyl-2-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 83048942
N-ethyl-7,8-dihydro-6H-[1,3]dioxolo[4,5-g]chromen-8-amine
CID 43512405
6-ethyl-1,3-benzodioxol-5-amine;N-methylmethanamine
CID 70549954
5-chloro-N,2-diethyl-2,3-dihydro-1-benzofuran-3-amine
CID 64663227
2-ethyl-N-methoxy-5-methyl-2,3-dihydro-1-benzofuran-3-amine
CID 81482053
2-ethyl-N,6-dimethoxy-2,3-dihydro-1-benzofuran-3-amine
CID 81482112
1-[(8S)-8-ethyl-6-methyl-8H-[1,3]dioxolo[4,5-g]chromen-7-yl]ethanone
CID 177499030
N-butyl-6,6-dimethyl-7,8-dihydro-[1,3]dioxolo[4,5-g]chromen-8-amine
CID 82462091
(6S,7R,8S)-7-methyl-8-(3,4,5-trimethoxyphenyl)-7,8-dihydro-6H-[1,3]dioxolo[4,5-g]chromen-6-ol
CID 11909210

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine?
The IUPAC name of 6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine (CID 64661825) is 6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine.
What is the SMILES notation for 6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine?
The canonical SMILES for 6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine is CCC1Oc2cc3c(cc2C1NC)OCO3.
What is the InChIKey of 6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine?
The InChIKey is WZOPHZFMGMMTJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3/c1-3-8-12(13-2)7-4-10-11(15-6-14-10)5-9(7)16-8/h4-5,8,12-13H,3,6H2,1-2H3.
What are the key properties of 6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine?
6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine has a molecular weight of 221.26 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine is sourced from PubChem (CID 64661825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).