2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine

C55H70N10O4 — CID 157336830

About 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine

2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine (PubChem CID 157336830) has the molecular formula C55H70N10O4 and a molecular weight of 935.23 g/mol. Its IUPAC name is 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine.

Molecular Properties

• Compound Name: 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine
• PubChem CID: 157336830
• Molecular Formula: C55H70N10O4
• Molecular Weight: 935.23 g/mol
• Exact Mass: 934.56
• IUPAC Name: 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine
• SMILES: CCc1ccc(N)c2cc[nH]c12.COCCOc1ccc(N)c2c(C)c(C)[nH]c12.Cc1ccc(N)c2c(CCCO)c[nH]c12.Cc1ccc(N)c2c(CCO)c[nH]c12.Cc1ccc(N)c2cc[nH]c12
• InChI: InChI=1S/C13H18N2O2.C12H16N2O.C11H14N2O.C10H12N2.C9H10N2/c1-8-9(2)15-13-11(17-7-6-16-3)5-4-10(14)12(8)13;1-8-4-5-10(13)11-9(3-2-6-15)7-14-12(8)11;1-7-2-3-9(12)10-8(4-5-14)6-13-11(7)10;1-2-7-3-4-9(11)8-5-6-12-10(7)8;1-6-2-3-8(10)7-4-5-11-9(6)7/h4-5,15H,6-7,14H2,1-3H3;4-5,7,14-15H,2-3,6,13H2,1H3;2-3,6,13-14H,4-5,12H2,1H3;3-6,12H,2,11H2,1H3;2-5,11H,10H2,1H3
• InChIKey: BFXWKPIOJYHAFG-UHFFFAOYSA-N
• XLogP: 10.34
• TPSA: 267.97 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 9
• Rotatable Bonds: 10
• Heavy Atoms: 69
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	935.23
LogP ≤ 5	10.34
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine?

The IUPAC name of 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine (CID 157336830) is 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine.

What is the SMILES notation for 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine?

The canonical SMILES for 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine is CCc1ccc(N)c2cc[nH]c12.COCCOc1ccc(N)c2c(C)c(C)[nH]c12.Cc1ccc(N)c2c(CCCO)c[nH]c12.Cc1ccc(N)c2c(CCO)c[nH]c12.Cc1ccc(N)c2cc[nH]c12.

What is the InChIKey of 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine?

The InChIKey is BFXWKPIOJYHAFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2.C12H16N2O.C11H14N2O.C10H12N2.C9H10N2/c1-8-9(2)15-13-11(17-7-6-16-3)5-4-10(14)12(8)13;1-8-4-5-10(13)11-9(3-2-6-15)7-14-12(8)11;1-7-2-3-9(12)10-8(4-5-14)6-13-11(7)10;1-2-7-3-4-9(11)8-5-6-12-10(7)8;1-6-2-3-8(10)7-4-5-11-9(6)7/h4-5,15H,6-7,14H2,1-3H3;4-5,7,14-15H,2-3,6,13H2,1H3;2-3,6,13-14H,4-5,12H2,1H3;3-6,12H,2,11H2,1H3;2-5,11H,10H2,1H3.

What are the key properties of 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine?

2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine has a molecular weight of 935.23 g/mol, XLogP of 10.34, 10 rotatable bonds, 12 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine is sourced from PubChem (CID 157336830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).