6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol

C13H15NO — CID 65333002

IUPAC6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol
SMILESCc1cc(C)c2c3c([nH]c2c1)CCC3O
InChIInChI=1S/C13H15NO/c1-7-5-8(2)12-10(6-7)14-9-3-4-11(15)13(9)12/h5-6,11,14-15H,3-4H2,1-2H3
InChIKeyNSCYFZQURJWXLC-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.76
Rot. Bonds

About 6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol

6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol (PubChem CID 65333002) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol.

Molecular Properties

Compound Name6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol
PubChem CID65333002
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol
SMILESCc1cc(C)c2c3c([nH]c2c1)CCC3O
InChIInChI=1S/C13H15NO/c1-7-5-8(2)12-10(6-7)14-9-3-4-11(15)13(9)12/h5-6,11,14-15H,3-4H2,1-2H3
InChIKeyNSCYFZQURJWXLC-UHFFFAOYSA-N
XLogP2.76
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol?
The IUPAC name of 6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol (CID 65333002) is 6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol.
What is the SMILES notation for 6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol?
The canonical SMILES for 6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol is Cc1cc(C)c2c3c([nH]c2c1)CCC3O.
What is the InChIKey of 6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol?
The InChIKey is NSCYFZQURJWXLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-7-5-8(2)12-10(6-7)14-9-3-4-11(15)13(9)12/h5-6,11,14-15H,3-4H2,1-2H3.
What are the key properties of 6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol?
6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol has a molecular weight of 201.27 g/mol, XLogP of 2.76, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dimethyl-1,2,3,4-tetrahydrocyclopenta[b]indol-1-ol is sourced from PubChem (CID 65333002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).