3-(1-aminocyclohexyl)-1-methylindol-6-ol

C15H20N2O — CID 82664795

IUPAC3-(1-aminocyclohexyl)-1-methylindol-6-ol
SMILESCn1cc(C2(N)CCCCC2)c2ccc(O)cc21
InChIInChI=1S/C15H20N2O/c1-17-10-13(15(16)7-3-2-4-8-15)12-6-5-11(18)9-14(12)17/h5-6,9-10,18H,2-4,7-8,16H2,1H3
InChIKeyKTTHXVLKYHNDQL-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.00
Rot. Bonds1

About 3-(1-aminocyclohexyl)-1-methylindol-6-ol

3-(1-aminocyclohexyl)-1-methylindol-6-ol (PubChem CID 82664795) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 3-(1-aminocyclohexyl)-1-methylindol-6-ol.

Molecular Properties

Compound Name3-(1-aminocyclohexyl)-1-methylindol-6-ol
PubChem CID82664795
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name3-(1-aminocyclohexyl)-1-methylindol-6-ol
SMILESCn1cc(C2(N)CCCCC2)c2ccc(O)cc21
InChIInChI=1S/C15H20N2O/c1-17-10-13(15(16)7-3-2-4-8-15)12-6-5-11(18)9-14(12)17/h5-6,9-10,18H,2-4,7-8,16H2,1H3
InChIKeyKTTHXVLKYHNDQL-UHFFFAOYSA-N
XLogP3.00
TPSA51.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(1-aminocyclohexyl)-1-methylindol-6-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(1-aminocyclohexyl)-1-methylindol-6-ol?
The IUPAC name of 3-(1-aminocyclohexyl)-1-methylindol-6-ol (CID 82664795) is 3-(1-aminocyclohexyl)-1-methylindol-6-ol.
What is the SMILES notation for 3-(1-aminocyclohexyl)-1-methylindol-6-ol?
The canonical SMILES for 3-(1-aminocyclohexyl)-1-methylindol-6-ol is Cn1cc(C2(N)CCCCC2)c2ccc(O)cc21.
What is the InChIKey of 3-(1-aminocyclohexyl)-1-methylindol-6-ol?
The InChIKey is KTTHXVLKYHNDQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-17-10-13(15(16)7-3-2-4-8-15)12-6-5-11(18)9-14(12)17/h5-6,9-10,18H,2-4,7-8,16H2,1H3.
What are the key properties of 3-(1-aminocyclohexyl)-1-methylindol-6-ol?
3-(1-aminocyclohexyl)-1-methylindol-6-ol has a molecular weight of 244.34 g/mol, XLogP of 3.00, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-aminocyclohexyl)-1-methylindol-6-ol is sourced from PubChem (CID 82664795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).