[1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol

C18H17NO2 — CID 66364392

IUPAC[1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol
SMILESOCc1cccc2c1ccn2CC1Cc2ccccc2O1
InChIInChI=1S/C18H17NO2/c20-12-14-5-3-6-17-16(14)8-9-19(17)11-15-10-13-4-1-2-7-18(13)21-15/h1-9,15,20H,10-12H2
InChIKeyZGIWUVFMRWRMLH-UHFFFAOYSA-N
MW279.34 g/mol
LogP3.14
Rot. Bonds3

About [1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol

[1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol (PubChem CID 66364392) has the molecular formula C18H17NO2 and a molecular weight of 279.34 g/mol. Its IUPAC name is [1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol.

Molecular Properties

Compound Name[1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol
PubChem CID66364392
Molecular FormulaC18H17NO2
Molecular Weight279.34 g/mol
Exact Mass279.13
IUPAC Name[1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol
SMILESOCc1cccc2c1ccn2CC1Cc2ccccc2O1
InChIInChI=1S/C18H17NO2/c20-12-14-5-3-6-17-16(14)8-9-19(17)11-15-10-13-4-1-2-7-18(13)21-15/h1-9,15,20H,10-12H2
InChIKeyZGIWUVFMRWRMLH-UHFFFAOYSA-N
XLogP3.14
TPSA34.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,3-dihydro-1-benzofuran-2-ylmethyl)-4-fluoroindole
CID 82782530
1-(2,3-dihydro-1-benzofuran-2-ylmethyl)pyrrole-2-carboxylic acid
CID 62234275
[1-(2,3-dihydro-1-benzofuran-2-ylmethyl)-2-methylpyrrol-3-yl]methanamine
CID 114195982
1-(2,3-dihydro-1-benzofuran-2-ylmethyl)-5-methylindole
CID 116623048
1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indole-5-carbaldehyde
CID 102910872
1-(2,3-dihydro-1-benzofuran-2-ylmethyl)imidazol-2-amine
CID 106569539
1-(2,3-dihydro-1-benzofuran-2-ylmethyl)-6,7-dihydro-5H-indol-4-one
CID 62233023
1-(2,3-dihydro-1-benzofuran-2-ylmethyl)-N-ethylimidazol-2-amine
CID 106569578
N-[[1-(2,3-dihydro-1-benzofuran-2-ylmethyl)pyrrol-3-yl]methyl]ethanamine
CID 66406529
3-[[(2R)-2,3-dihydro-1-benzofuran-2-yl]methyl]pyrimidin-4-one
CID 99610232
1-[1-(2,3-dihydro-1-benzofuran-2-ylmethyl)pyrrol-3-yl]-N-methylmethanamine
CID 66404078
1-(2,3-dihydro-1-benzofuran-2-ylmethyl)azetidine-3-carboxylic acid
CID 66364000

Frequently Asked Questions

What is the IUPAC name of [1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol?
The IUPAC name of [1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol (CID 66364392) is [1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol.
What is the SMILES notation for [1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol?
The canonical SMILES for [1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol is OCc1cccc2c1ccn2CC1Cc2ccccc2O1.
What is the InChIKey of [1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol?
The InChIKey is ZGIWUVFMRWRMLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO2/c20-12-14-5-3-6-17-16(14)8-9-19(17)11-15-10-13-4-1-2-7-18(13)21-15/h1-9,15,20H,10-12H2.
What are the key properties of [1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol?
[1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol has a molecular weight of 279.34 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,3-dihydro-1-benzofuran-2-ylmethyl)indol-4-yl]methanol is sourced from PubChem (CID 66364392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).