[1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol

C15H19NO2 — CID 115243599

IUPAC[1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol
SMILESCN(Cc1coc2ccccc12)CC1(CO)CC1
InChIInChI=1S/C15H19NO2/c1-16(10-15(11-17)6-7-15)8-12-9-18-14-5-3-2-4-13(12)14/h2-5,9,17H,6-8,10-11H2,1H3
InChIKeyGHMZYBOCJYBMHT-UHFFFAOYSA-N
MW245.32 g/mol
LogP2.64
Rot. Bonds5

About [1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol

[1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol (PubChem CID 115243599) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is [1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol
PubChem CID115243599
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name[1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol
SMILESCN(Cc1coc2ccccc12)CC1(CO)CC1
InChIInChI=1S/C15H19NO2/c1-16(10-15(11-17)6-7-15)8-12-9-18-14-5-3-2-4-13(12)14/h2-5,9,17H,6-8,10-11H2,1H3
InChIKeyGHMZYBOCJYBMHT-UHFFFAOYSA-N
XLogP2.64
TPSA36.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]-3-methylbutan-1-ol
CID 115252165
[1-(1-benzofuran-3-ylmethylamino)cyclopropyl]methanol
CID 115763206
N-(1-benzofuran-3-ylmethyl)-N-methylbut-2-en-1-amine
CID 176732018
N'-(1-benzofuran-3-ylmethyl)-N,N'-dimethylbutane-1,4-diamine
CID 115202069
1-(azetidin-3-yl)-N-(1-benzofuran-3-ylmethyl)-N-methylmethanamine
CID 115207722
[1-[[methyl-[(2-methylphenyl)methyl]amino]methyl]cyclohexyl]methanol
CID 55055377
1-[[2-(1-benzofuran-3-yl)ethyl-methylamino]methyl]cyclopropane-1-carbonitrile
CID 115242624
N'-(1-benzofuran-3-ylmethyl)-N',2,2-trimethylpropane-1,3-diamine
CID 80702542
N-(1-benzofuran-3-ylmethyl)-3-hydroxy-N-methylpropanamide
CID 115139234
(2E,4E)-N-(1-benzofuran-3-ylmethyl)-N-methyl-5-(4-phenylphenyl)penta-2,4-dien-1-amine
CID 134559949
N-(1-benzofuran-3-ylmethyl)-N-methyl-3-(4-phenylphenyl)prop-2-yn-1-amine
CID 134559970
N-(1-benzofuran-3-ylmethyl)-N-methyl-2-piperazin-1-ylethanamine
CID 80702164

Frequently Asked Questions

What is the IUPAC name of [1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol?
The IUPAC name of [1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol (CID 115243599) is [1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol is CN(Cc1coc2ccccc12)CC1(CO)CC1.
What is the InChIKey of [1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol?
The InChIKey is GHMZYBOCJYBMHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-16(10-15(11-17)6-7-15)8-12-9-18-14-5-3-2-4-13(12)14/h2-5,9,17H,6-8,10-11H2,1H3.
What are the key properties of [1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol?
[1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol has a molecular weight of 245.32 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[1-benzofuran-3-ylmethyl(methyl)amino]methyl]cyclopropyl]methanol is sourced from PubChem (CID 115243599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).