2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine

C14H20N2O — CID 84627124

IUPAC2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine
SMILESCOc1ccc(C)c2c(C(C)(C)N)c(C)[nH]c12
InChIInChI=1S/C14H20N2O/c1-8-6-7-10(17-5)13-11(8)12(9(2)16-13)14(3,4)15/h6-7,16H,15H2,1-5H3
InChIKeyKLXZERSCLUBQRB-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.99
Rot. Bonds2

About 2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine

2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine (PubChem CID 84627124) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine.

Molecular Properties

Compound Name2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine
PubChem CID84627124
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine
SMILESCOc1ccc(C)c2c(C(C)(C)N)c(C)[nH]c12
InChIInChI=1S/C14H20N2O/c1-8-6-7-10(17-5)13-11(8)12(9(2)16-13)14(3,4)15/h6-7,16H,15H2,1-5H3
InChIKeyKLXZERSCLUBQRB-UHFFFAOYSA-N
XLogP2.99
TPSA51.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)-2-methylpropanoic acid
CID 82500844
3-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-1-ol
CID 82496131
7-methoxy-3,4-dimethyl-1H-indole-2-carbaldehyde
CID 82373470
(7-methoxy-3,4-dimethyl-1H-indol-2-yl)methanol
CID 84620551
3-chloro-7-methoxy-4-methyl-1H-indole-2-carbaldehyde
CID 82391920
2-(4-methoxy-2,7-dimethyl-1H-indol-3-yl)ethanamine
CID 105472778
2-(2-fluoro-3,6-dimethoxyphenyl)propan-2-amine
CID 84782823
2-(2-bromo-3,6-dimethoxyphenyl)propan-2-amine
CID 84810436
2-(3-bromo-6-methoxy-2-methylphenyl)propan-2-amine
CID 84805905
2-(difluoromethyl)-8-methoxy-5-methyl-1H-quinolin-4-one
CID 55127526
2-(2,3-difluoro-6-methoxyphenyl)propan-2-amine
CID 83410012
8-methoxy-5-methyl-1H-quinoline-4-thione
CID 84620575

Frequently Asked Questions

What is the IUPAC name of 2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine?
The IUPAC name of 2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine (CID 84627124) is 2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine.
What is the SMILES notation for 2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine?
The canonical SMILES for 2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine is COc1ccc(C)c2c(C(C)(C)N)c(C)[nH]c12.
What is the InChIKey of 2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine?
The InChIKey is KLXZERSCLUBQRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-8-6-7-10(17-5)13-11(8)12(9(2)16-13)14(3,4)15/h6-7,16H,15H2,1-5H3.
What are the key properties of 2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine?
2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine has a molecular weight of 232.33 g/mol, XLogP of 2.99, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methoxy-2,4-dimethyl-1H-indol-3-yl)propan-2-amine is sourced from PubChem (CID 84627124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).