5-methyl-3a,7a-dihydro-1H-indol-7-ol

C9H11NO — CID 143778533

IUPAC5-methyl-3a,7a-dihydro-1H-indol-7-ol
SMILESCC1=CC2C=CNC2C(O)=C1
InChIInChI=1S/C9H11NO/c1-6-4-7-2-3-10-9(7)8(11)5-6/h2-5,7,9-11H,1H3
InChIKeyNXEFOYAURDIUKS-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.49
Rot. Bonds

About 5-methyl-3a,7a-dihydro-1H-indol-7-ol

5-methyl-3a,7a-dihydro-1H-indol-7-ol (PubChem CID 143778533) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 5-methyl-3a,7a-dihydro-1H-indol-7-ol.

Molecular Properties

Compound Name5-methyl-3a,7a-dihydro-1H-indol-7-ol
PubChem CID143778533
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name5-methyl-3a,7a-dihydro-1H-indol-7-ol
SMILESCC1=CC2C=CNC2C(O)=C1
InChIInChI=1S/C9H11NO/c1-6-4-7-2-3-10-9(7)8(11)5-6/h2-5,7,9-11H,1H3
InChIKeyNXEFOYAURDIUKS-UHFFFAOYSA-N
XLogP1.49
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,8a-Dihydroquinolin-8-ol
CID 58161039
5-ethyl-3a,7a-dihydro-1H-indol-6-ol
CID 68345621
5-ethyl-3a,7a-dihydro-1H-indol-7-ol
CID 68345622
2-Ethyl-1,2-dihydropyridin-3-ol
CID 70065292
5-tert-butyl-3a,7a-dihydro-1H-indol-6-ol
CID 89199090
5-methyl-3a,7a-dihydro-1H-indol-6-ol;propane
CID 143778564
5-methyl-3a,7a-dihydro-1H-indol-6-ol
CID 143778565
5-methyl-3a,7a-dihydro-1H-indol-7-ol;propane
CID 143778580
3a,7a-dihydro-1H-indol-4-ol
CID 146475746
5-chloro-3a,7a-dihydro-1H-indol-4-ol
CID 146475825
5,6-dihydro-1H-indol-4-ol
CID 148622350
2-(1,2-Dihydropyridin-2-yl)propan-2-ol
CID 148824024

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3a,7a-dihydro-1H-indol-7-ol?
The IUPAC name of 5-methyl-3a,7a-dihydro-1H-indol-7-ol (CID 143778533) is 5-methyl-3a,7a-dihydro-1H-indol-7-ol.
What is the SMILES notation for 5-methyl-3a,7a-dihydro-1H-indol-7-ol?
The canonical SMILES for 5-methyl-3a,7a-dihydro-1H-indol-7-ol is CC1=CC2C=CNC2C(O)=C1.
What is the InChIKey of 5-methyl-3a,7a-dihydro-1H-indol-7-ol?
The InChIKey is NXEFOYAURDIUKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-6-4-7-2-3-10-9(7)8(11)5-6/h2-5,7,9-11H,1H3.
What are the key properties of 5-methyl-3a,7a-dihydro-1H-indol-7-ol?
5-methyl-3a,7a-dihydro-1H-indol-7-ol has a molecular weight of 149.19 g/mol, XLogP of 1.49, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3a,7a-dihydro-1H-indol-7-ol is sourced from PubChem (CID 143778533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).