5-(1-hydroxycyclopropyl)-1H-indol-4-ol

C11H11NO2 — CID 117281432

IUPAC5-(1-hydroxycyclopropyl)-1H-indol-4-ol
SMILESOc1c(C2(O)CC2)ccc2[nH]ccc12
InChIInChI=1S/C11H11NO2/c13-10-7-3-6-12-9(7)2-1-8(10)11(14)4-5-11/h1-3,6,12-14H,4-5H2
InChIKeyXQOLBPGINRZDME-UHFFFAOYSA-N
MW189.21 g/mol
LogP1.85
Rot. Bonds1

About 5-(1-hydroxycyclopropyl)-1H-indol-4-ol

5-(1-hydroxycyclopropyl)-1H-indol-4-ol (PubChem CID 117281432) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is 5-(1-hydroxycyclopropyl)-1H-indol-4-ol.

Molecular Properties

Compound Name5-(1-hydroxycyclopropyl)-1H-indol-4-ol
PubChem CID117281432
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name5-(1-hydroxycyclopropyl)-1H-indol-4-ol
SMILESOc1c(C2(O)CC2)ccc2[nH]ccc12
InChIInChI=1S/C11H11NO2/c13-10-7-3-6-12-9(7)2-1-8(10)11(14)4-5-11/h1-3,6,12-14H,4-5H2
InChIKeyXQOLBPGINRZDME-UHFFFAOYSA-N
XLogP1.85
TPSA56.25 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 51.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

5-iodo-1H-indol-4-ol
CID 15979130
5-[(1-aminocyclopropyl)methyl]-1H-indol-4-ol
CID 117290934
8-(1H-indol-4-yl)-1,4-dioxaspiro[4.5]decan-8-ol
CID 115351923
5-(1-hydroxycyclopropyl)-1,3-benzodioxol-4-ol
CID 117284324
4-(1H-indol-4-yl)-1-methylazepan-4-ol
CID 115351908
1H-indol-4-ol
CID 102220556
1-(4-methoxy-1H-indol-5-yl)cyclohexane-1-carboxylic acid
CID 117435907
3-(1-hydroxycyclopropyl)-6-(trifluoromethyl)benzene-1,2-diol
CID 117339821
5-(1-amino-2-methylpropyl)-1H-indol-4-ol
CID 76846445
3-(1H-indol-4-yl)-1-methylpiperidin-3-ol
CID 12900687
4-(1H-indol-4-yl)-1-propylazepan-4-ol
CID 115351910
1-(1H-indol-4-yl)-3-propan-2-ylcyclohexan-1-ol
CID 107449693

Frequently Asked Questions

What is the IUPAC name of 5-(1-hydroxycyclopropyl)-1H-indol-4-ol?
The IUPAC name of 5-(1-hydroxycyclopropyl)-1H-indol-4-ol (CID 117281432) is 5-(1-hydroxycyclopropyl)-1H-indol-4-ol.
What is the SMILES notation for 5-(1-hydroxycyclopropyl)-1H-indol-4-ol?
The canonical SMILES for 5-(1-hydroxycyclopropyl)-1H-indol-4-ol is Oc1c(C2(O)CC2)ccc2[nH]ccc12.
What is the InChIKey of 5-(1-hydroxycyclopropyl)-1H-indol-4-ol?
The InChIKey is XQOLBPGINRZDME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c13-10-7-3-6-12-9(7)2-1-8(10)11(14)4-5-11/h1-3,6,12-14H,4-5H2.
What are the key properties of 5-(1-hydroxycyclopropyl)-1H-indol-4-ol?
5-(1-hydroxycyclopropyl)-1H-indol-4-ol has a molecular weight of 189.21 g/mol, XLogP of 1.85, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-hydroxycyclopropyl)-1H-indol-4-ol is sourced from PubChem (CID 117281432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).