2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol

C8H9NO2 — CID 91438460

IUPAC2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol
SMILESCn1c(O)c2c(c1O)CC=C2
InChIInChI=1S/C8H9NO2/c1-9-7(10)5-3-2-4-6(5)8(9)11/h2-3,10-11H,4H2,1H3
InChIKeyJRGWSSZBILDOBI-UHFFFAOYSA-N
MW151.16 g/mol
LogP1.01
Rot. Bonds

About 2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol

2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol (PubChem CID 91438460) has the molecular formula C8H9NO2 and a molecular weight of 151.16 g/mol. Its IUPAC name is 2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol.

Molecular Properties

Compound Name2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol
PubChem CID91438460
Molecular FormulaC8H9NO2
Molecular Weight151.16 g/mol
Exact Mass151.06
IUPAC Name2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol
SMILESCn1c(O)c2c(c1O)CC=C2
InChIInChI=1S/C8H9NO2/c1-9-7(10)5-3-2-4-6(5)8(9)11/h2-3,10-11H,4H2,1H3
InChIKeyJRGWSSZBILDOBI-UHFFFAOYSA-N
XLogP1.01
TPSA45.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol?
The IUPAC name of 2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol (CID 91438460) is 2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol.
What is the SMILES notation for 2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol?
The canonical SMILES for 2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol is Cn1c(O)c2c(c1O)CC=C2.
What is the InChIKey of 2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol?
The InChIKey is JRGWSSZBILDOBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO2/c1-9-7(10)5-3-2-4-6(5)8(9)11/h2-3,10-11H,4H2,1H3.
What are the key properties of 2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol?
2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol has a molecular weight of 151.16 g/mol, XLogP of 1.01, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6H-cyclopenta[c]pyrrole-1,3-diol is sourced from PubChem (CID 91438460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).