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

C13H17NO3 — CID 83050298

IUPACN-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine
SMILESCCCC1Oc2cc3c(cc2C1NC)OCO3
InChIInChI=1S/C13H17NO3/c1-3-4-9-13(14-2)8-5-11-12(16-7-15-11)6-10(8)17-9/h5-6,9,13-14H,3-4,7H2,1-2H3
InChIKeyFJSSQYHWXCALIO-UHFFFAOYSA-N
MW235.28 g/mol
LogP2.24
Rot. Bonds3

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

N-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine (PubChem CID 83050298) has the molecular formula C13H17NO3 and a molecular weight of 235.28 g/mol. Its IUPAC name is N-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine.

Molecular Properties

Compound NameN-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine
PubChem CID83050298
Molecular FormulaC13H17NO3
Molecular Weight235.28 g/mol
Exact Mass235.12
IUPAC NameN-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine
SMILESCCCC1Oc2cc3c(cc2C1NC)OCO3
InChIInChI=1S/C13H17NO3/c1-3-4-9-13(14-2)8-5-11-12(16-7-15-11)6-10(8)17-9/h5-6,9,13-14H,3-4,7H2,1-2H3
InChIKeyFJSSQYHWXCALIO-UHFFFAOYSA-N
XLogP2.24
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.28
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine with MolForge

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Related Compounds

6-ethyl-N-methyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine
CID 64661825
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
4,6-difluoro-N-methyl-2-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 83049517
5-bromo-7-fluoro-N-methyl-2-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 83048927
5-bromo-6-fluoro-N,2-dipropyl-2,3-dihydro-1-benzofuran-3-amine
CID 83049037
5-bromo-N-ethyl-2-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 83049616
N,4,7-trimethyl-2-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 83048813
5-ethoxy-N-ethyl-2-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 83049821
2-ethyl-N-methyl-5-(2,4,4-trimethylpentan-2-yl)-2,3-dihydro-1-benzofuran-3-amine
CID 64661216
N-butyl-6,6-dimethyl-7,8-dihydro-[1,3]dioxolo[4,5-g]chromen-8-amine
CID 82462091
5-butan-2-yl-N-ethyl-2-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 107667200

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine?
The IUPAC name of N-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine (CID 83050298) is N-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine.
What is the SMILES notation for N-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine?
The canonical SMILES for N-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine is CCCC1Oc2cc3c(cc2C1NC)OCO3.
What is the InChIKey of N-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine?
The InChIKey is FJSSQYHWXCALIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO3/c1-3-4-9-13(14-2)8-5-11-12(16-7-15-11)6-10(8)17-9/h5-6,9,13-14H,3-4,7H2,1-2H3.
What are the key properties of N-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine?
N-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine has a molecular weight of 235.28 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-propyl-6,7-dihydrofuro[2,3-f][1,3]benzodioxol-7-amine is sourced from PubChem (CID 83050298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).