2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine

C23H30N6O2 — CID 90727053

IUPAC2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine
SMILESCNCCOc1cc(N2CCOCC2)cc(C/N=N/c2ccc3[nH]c(C)c(C)c3c2)n1
InChIInChI=1S/C23H30N6O2/c1-16-17(2)26-22-5-4-18(13-21(16)22)28-25-15-19-12-20(29-7-10-30-11-8-29)14-23(27-19)31-9-6-24-3/h4-5,12-14,24,26H,6-11,15H2,1-3H3/b28-25+
InChIKeyOCGIZVFOGCLLJD-AZPGRJICSA-N
MW422.53 g/mol
LogP3.90
Rot. Bonds8

About 2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine

2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine (PubChem CID 90727053) has the molecular formula C23H30N6O2 and a molecular weight of 422.53 g/mol. Its IUPAC name is 2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine.

Molecular Properties

Compound Name2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine
PubChem CID90727053
Molecular FormulaC23H30N6O2
Molecular Weight422.53 g/mol
Exact Mass422.24
IUPAC Name2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine
SMILESCNCCOc1cc(N2CCOCC2)cc(C/N=N/c2ccc3[nH]c(C)c(C)c3c2)n1
InChIInChI=1S/C23H30N6O2/c1-16-17(2)26-22-5-4-18(13-21(16)22)28-25-15-19-12-20(29-7-10-30-11-8-29)14-23(27-19)31-9-6-24-3/h4-5,12-14,24,26H,6-11,15H2,1-3H3/b28-25+
InChIKeyOCGIZVFOGCLLJD-AZPGRJICSA-N
XLogP3.90
TPSA87.13 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.53
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

Analyze 2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine 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

(4,5-dimethylfuran-2-yl)-[[4-morpholin-4-yl-6-(2-morpholin-4-ylethoxy)-2-pyridinyl]methyl]diazene
CID 91613854
N-[(E)-[6-[2-(methylamino)ethoxy]-4-morpholin-4-yl-2-pyridinyl]methylideneamino]-1H-indol-3-amine
CID 11474893
6-[2-(methylamino)ethoxy]-N-[(E)-(3-methylphenyl)methylideneamino]-4-morpholin-4-ylpyridin-2-amine
CID 11314679
6-[2-(methylamino)ethoxy]-N-[(3-methylphenyl)methylideneamino]-4-morpholin-4-ylpyridin-2-amine
CID 66683567
N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-1-[4-morpholin-4-yl-6-(2-pyridin-2-ylethoxy)pyrimidin-2-yl]methanimine
CID 58060102
ethyl N-[2-[[6-[[(3-methylphenyl)methylideneamino]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]ethyl]carbamate
CID 58060069
2,3-dimethyl-N-[2-morpholin-4-yl-6-[2-(3,4,5-trimethoxyphenyl)ethoxy]-4-pyridinyl]-1H-indol-5-amine
CID 59218180
N-[(E)-[6-[2-(methylamino)ethoxy]-4-morpholin-4-yl-2-pyridinyl]methylideneamino]-3a,7a-dihydro-1H-indol-3-amine
CID 89176033
(3,4-dimethylphenyl)-[[6-morpholin-4-yl-2-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]methyl]diazene
CID 91029551
(3,4-dimethylphenyl)methyl-[4-morpholin-4-yl-6-(2-morpholin-4-ylethoxy)-2-pyridinyl]diazene
CID 90855310
N-(2,3-dimethyl-1H-indol-5-yl)-6-(2-methylsulfonylethoxy)-2-morpholin-4-ylpyrimidine-4-carboxamide
CID 59258584
1-(3-methylphenyl)-N-[[6-[2-(2-methyl-1,3-thiazol-5-yl)ethoxy]-4-morpholin-4-yl-2-pyridinyl]methyl]methanimine
CID 58060439

Frequently Asked Questions

What is the IUPAC name of 2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine?
The IUPAC name of 2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine (CID 90727053) is 2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine.
What is the SMILES notation for 2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine?
The canonical SMILES for 2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine is CNCCOc1cc(N2CCOCC2)cc(C/N=N/c2ccc3[nH]c(C)c(C)c3c2)n1.
What is the InChIKey of 2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine?
The InChIKey is OCGIZVFOGCLLJD-AZPGRJICSA-N. The full InChI is InChI=1S/C23H30N6O2/c1-16-17(2)26-22-5-4-18(13-21(16)22)28-25-15-19-12-20(29-7-10-30-11-8-29)14-23(27-19)31-9-6-24-3/h4-5,12-14,24,26H,6-11,15H2,1-3H3/b28-25+.
What are the key properties of 2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine?
2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine has a molecular weight of 422.53 g/mol, XLogP of 3.90, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-[[(2,3-dimethyl-1H-indol-5-yl)diazenyl]methyl]-4-morpholin-4-yl-2-pyridinyl]oxy]-N-methylethanamine is sourced from PubChem (CID 90727053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).