8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol

C15H16N2O3 — CID 117433511

IUPAC8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol
SMILESOc1c2ccoc2c(CN2CCNCC2)c2ccoc12
InChIInChI=1S/C15H16N2O3/c18-13-11-2-8-19-14(11)12(10-1-7-20-15(10)13)9-17-5-3-16-4-6-17/h1-2,7-8,16,18H,3-6,9H2
InChIKeyIJCBVVGCKYTHST-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.29
Rot. Bonds2

About 8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol

8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol (PubChem CID 117433511) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is 8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol.

Molecular Properties

Compound Name8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol
PubChem CID117433511
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Name8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol
SMILESOc1c2ccoc2c(CN2CCNCC2)c2ccoc12
InChIInChI=1S/C15H16N2O3/c18-13-11-2-8-19-14(11)12(10-1-7-20-15(10)13)9-17-5-3-16-4-6-17/h1-2,7-8,16,18H,3-6,9H2
InChIKeyIJCBVVGCKYTHST-UHFFFAOYSA-N
XLogP2.29
TPSA61.78 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(piperazin-1-ylmethyl)-1-benzofuran-7-ol
CID 96806763
1-[(2,6-dichlorophenyl)methyl]piperazine
CID 770796
4-(piperazin-1-ylmethyl)benzene-1,2,3-triol
CID 12900434
2-(piperazin-1-ylmethyl)-3-(trifluoromethyl)phenol
CID 84710181
3-(piperazin-1-ylmethyl)furan-2-carboxylic acid;dihydrochloride
CID 50988437
[2-(piperazin-1-ylmethyl)furan-3-yl]methanethiol
CID 82508549
5-(piperazin-1-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-ol
CID 117379256
3-(piperazin-1-ylmethyl)-1-benzofuran-6-ol
CID 117177562
3-chloro-4-methyl-2-(piperazin-1-ylmethyl)phenol
CID 84800713
2-chloro-3,5-dimethyl-6-(piperazin-1-ylmethyl)phenol
CID 117390249
[3-(piperazin-1-ylmethyl)phenyl]methanol
CID 23023149
2-(1,4-diazepan-1-ylmethyl)furan-3-carboxylic acid
CID 61397796

Frequently Asked Questions

What is the IUPAC name of 8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol?
The IUPAC name of 8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol (CID 117433511) is 8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol.
What is the SMILES notation for 8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol?
The canonical SMILES for 8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol is Oc1c2ccoc2c(CN2CCNCC2)c2ccoc12.
What is the InChIKey of 8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol?
The InChIKey is IJCBVVGCKYTHST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c18-13-11-2-8-19-14(11)12(10-1-7-20-15(10)13)9-17-5-3-16-4-6-17/h1-2,7-8,16,18H,3-6,9H2.
What are the key properties of 8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol?
8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol has a molecular weight of 272.30 g/mol, XLogP of 2.29, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(piperazin-1-ylmethyl)furo[2,3-f][1]benzofuran-4-ol is sourced from PubChem (CID 117433511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).