1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine

C14H19N3O2 — CID 82023577

IUPAC1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine
SMILESCN(C)C(C1=NCCN1)c1ccc2c(c1)OCCO2
InChIInChI=1S/C14H19N3O2/c1-17(2)13(14-15-5-6-16-14)10-3-4-11-12(9-10)19-8-7-18-11/h3-4,9,13H,5-8H2,1-2H3,(H,15,16)
InChIKeyMSSWBVOTOZKAOW-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.06
Rot. Bonds3

About 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine

1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine (PubChem CID 82023577) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine
PubChem CID82023577
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine
SMILESCN(C)C(C1=NCCN1)c1ccc2c(c1)OCCO2
InChIInChI=1S/C14H19N3O2/c1-17(2)13(14-15-5-6-16-14)10-3-4-11-12(9-10)19-8-7-18-11/h3-4,9,13H,5-8H2,1-2H3,(H,15,16)
InChIKeyMSSWBVOTOZKAOW-UHFFFAOYSA-N
XLogP1.06
TPSA46.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[4,5-dihydro-1H-imidazol-2-yl(dimethylamino)methyl]-2-methoxyphenol
CID 82023579
[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]azanium
CID 7047685
6-propan-2-yl-2,3-dihydro-1,4-benzodioxine
CID 22951095
2-chloro-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N,N-dimethylethanamine
CID 82084796
azane;methane;6-propan-2-yl-2,3-dihydro-1,4-benzodioxine
CID 159540292
bis(2,3-dihydro-1,4-benzodioxin-6-yl)methanol
CID 69205409
1-[2,3-dihydro-1,4-benzodioxin-6-yl(dimethylamino)methyl]cyclopropan-1-amine
CID 116914101
1,3-benzodioxol-5-yl(dimethylamino)methanol
CID 116909534
6-[(2S)-butan-2-yl]-2,3-dihydro-1,4-benzodioxine
CID 89291173
6-(3-chlorobutan-2-yl)-2,3-dihydro-1,4-benzodioxine
CID 66470243
14-(1-methoxyethyl)-2,5,8,11-tetraoxabicyclo[10.4.0]hexadeca-1(12),13,15-triene
CID 101134725
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-pyridin-4-ylpropan-1-ol
CID 66461480

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine (CID 82023577) is 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine is CN(C)C(C1=NCCN1)c1ccc2c(c1)OCCO2.
What is the InChIKey of 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine?
The InChIKey is MSSWBVOTOZKAOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-17(2)13(14-15-5-6-16-14)10-3-4-11-12(9-10)19-8-7-18-11/h3-4,9,13H,5-8H2,1-2H3,(H,15,16).
What are the key properties of 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine?
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine has a molecular weight of 261.32 g/mol, XLogP of 1.06, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4,5-dihydro-1H-imidazol-2-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 82023577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).