3-ethyl-2-methyl-1H-indol-7-ol

C11H13NO — CID 130049392

IUPAC3-ethyl-2-methyl-1H-indol-7-ol
SMILESCCc1c(C)[nH]c2c(O)cccc12
InChIInChI=1S/C11H13NO/c1-3-8-7(2)12-11-9(8)5-4-6-10(11)13/h4-6,12-13H,3H2,1-2H3
InChIKeyPSWYNFIVOXOVCU-UHFFFAOYSA-N
MW175.23 g/mol
LogP2.74
Rot. Bonds1

About 3-ethyl-2-methyl-1H-indol-7-ol

3-ethyl-2-methyl-1H-indol-7-ol (PubChem CID 130049392) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is 3-ethyl-2-methyl-1H-indol-7-ol.

Molecular Properties

Compound Name3-ethyl-2-methyl-1H-indol-7-ol
PubChem CID130049392
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name3-ethyl-2-methyl-1H-indol-7-ol
SMILESCCc1c(C)[nH]c2c(O)cccc12
InChIInChI=1S/C11H13NO/c1-3-8-7(2)12-11-9(8)5-4-6-10(11)13/h4-6,12-13H,3H2,1-2H3
InChIKeyPSWYNFIVOXOVCU-UHFFFAOYSA-N
XLogP2.74
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

2-(8-hydroxy-2-methyl-4-oxo-1H-quinolin-3-yl)acetic acid
CID 84696464
3-ethyl-2-methyl-7-[(2-methylphenyl)methoxy]-1H-indole
CID 142101066
3-ethyl-2-methyl-1H-indole;propane
CID 156727003
N-[(2,7-dimethyl-1H-indol-3-yl)methyl]ethanamine
CID 65335557
3-(2-aminopropan-2-yl)-2-methyl-1H-indol-7-ol
CID 96618503
N-[(7-methoxy-2-methyl-1H-indol-3-yl)methyl]ethanamine
CID 65335513
1-(3,7-diethyl-1H-indol-2-yl)ethanone
CID 21239672
(7-fluoro-2-methyl-1H-indol-3-yl)methanamine
CID 65335308
2-[(7-hydroxy-2-methyl-1H-indole-3-carbonyl)amino]acetic acid
CID 110835945
N-[3-(7-ethyl-2-methyl-1H-indol-3-yl)propyl]cyclopropanamine
CID 98784588
1-(2,7-dimethyl-1H-indol-3-yl)butan-2-amine
CID 130005740
2-[(7-ethyl-2-methyl-1H-indol-3-yl)methyl]cyclopentan-1-one
CID 84635790

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-methyl-1H-indol-7-ol?
The IUPAC name of 3-ethyl-2-methyl-1H-indol-7-ol (CID 130049392) is 3-ethyl-2-methyl-1H-indol-7-ol.
What is the SMILES notation for 3-ethyl-2-methyl-1H-indol-7-ol?
The canonical SMILES for 3-ethyl-2-methyl-1H-indol-7-ol is CCc1c(C)[nH]c2c(O)cccc12.
What is the InChIKey of 3-ethyl-2-methyl-1H-indol-7-ol?
The InChIKey is PSWYNFIVOXOVCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c1-3-8-7(2)12-11-9(8)5-4-6-10(11)13/h4-6,12-13H,3H2,1-2H3.
What are the key properties of 3-ethyl-2-methyl-1H-indol-7-ol?
3-ethyl-2-methyl-1H-indol-7-ol has a molecular weight of 175.23 g/mol, XLogP of 2.74, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-methyl-1H-indol-7-ol is sourced from PubChem (CID 130049392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).