1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine

C11H15NO — CID 141164132

IUPAC1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine
SMILESCN(C)Cc1cccc2c1CCO2
InChIInChI=1S/C11H15NO/c1-12(2)8-9-4-3-5-11-10(9)6-7-13-11/h3-5H,6-8H2,1-2H3
InChIKeyUZHGJCWTKOYORY-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.68
Rot. Bonds2

About 1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine

1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine (PubChem CID 141164132) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine
PubChem CID141164132
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine
SMILESCN(C)Cc1cccc2c1CCO2
InChIInChI=1S/C11H15NO/c1-12(2)8-9-4-3-5-11-10(9)6-7-13-11/h3-5H,6-8H2,1-2H3
InChIKeyUZHGJCWTKOYORY-UHFFFAOYSA-N
XLogP1.68
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(bromomethyl)-2,3-dihydro-1-benzofuran
CID 139534248
4-prop-2-enyl-2,3-dihydro-1-benzofuran
CID 67079342
1-(2,3-dihydro-1-benzofuran-4-ylmethyl)cyclopropan-1-amine
CID 117281579
(2S)-4-(2,3-dihydro-1-benzofuran-4-yl)butan-2-amine
CID 130612679
4-(2,3-dihydro-1-benzofuran-4-yl)butan-1-amine
CID 117282588
4-(2,3-dihydro-1-benzofuran-4-yl)-1-ethylpiperidine
CID 123608868
1-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-N-[[2-[(dimethylamino)methyl]phenyl]methyl]methanamine
CID 47038217
2,3-dihydro-1-benzofuran;ethane;propane
CID 91022099
4-butan-2-yl-2,3-dihydro-1-benzofuran
CID 144643347
1-[3-(2,3-dihydro-1-benzofuran-4-yl)-2,2-dimethylcyclopropyl]propan-1-one
CID 20778840
1-(2-methanidyl-1,2,3,4-tetrahydroisoquinolin-2-ium-5-yl)-N,N-dimethylmethanamine
CID 20825700
[2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methanamine
CID 18787377

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine (CID 141164132) is 1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine is CN(C)Cc1cccc2c1CCO2.
What is the InChIKey of 1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine?
The InChIKey is UZHGJCWTKOYORY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-12(2)8-9-4-3-5-11-10(9)6-7-13-11/h3-5H,6-8H2,1-2H3.
What are the key properties of 1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine?
1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine has a molecular weight of 177.25 g/mol, XLogP of 1.68, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1-benzofuran-4-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 141164132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).