4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol

C22H26N4O2 — CID 135605299

IUPAC4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol
SMILESCc1cccc2[nH]c(O)c(/C=N/c3ccc(NCCN4CCOCC4)cc3)c12
InChIInChI=1S/C22H26N4O2/c1-16-3-2-4-20-21(16)19(22(27)25-20)15-24-18-7-5-17(6-8-18)23-9-10-26-11-13-28-14-12-26/h2-8,15,23,25,27H,9-14H2,1H3/b24-15+
InChIKeySOUKQXOQNVGXNZ-BUVRLJJBSA-N
MW378.48 g/mol
LogP3.68
Rot. Bonds6

About 4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol

4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol (PubChem CID 135605299) has the molecular formula C22H26N4O2 and a molecular weight of 378.48 g/mol. Its IUPAC name is 4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol.

Molecular Properties

Compound Name4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol
PubChem CID135605299
Molecular FormulaC22H26N4O2
Molecular Weight378.48 g/mol
Exact Mass378.21
IUPAC Name4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol
SMILESCc1cccc2[nH]c(O)c(/C=N/c3ccc(NCCN4CCOCC4)cc3)c12
InChIInChI=1S/C22H26N4O2/c1-16-3-2-4-20-21(16)19(22(27)25-20)15-24-18-7-5-17(6-8-18)23-9-10-26-11-13-28-14-12-26/h2-8,15,23,25,27H,9-14H2,1H3/b24-15+
InChIKeySOUKQXOQNVGXNZ-BUVRLJJBSA-N
XLogP3.68
TPSA72.88 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.48
LogP ≤ 53.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

4-fluoro-3-[[3-methyl-4-(3-morpholin-4-ylpropylamino)phenyl]iminomethyl]-1H-indol-2-ol
CID 135605378
4-fluoro-3-[[3-fluoro-4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol
CID 135605535
3-[[4-(4-butylpiperazin-1-yl)phenyl]iminomethyl]-4-methyl-1H-indol-2-ol
CID 135605341
4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1,3-dihydroindol-2-one
CID 90985544
3-[[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]iminomethyl]-4-methyl-1H-indol-2-ol
CID 135605312
N,N-dimethyl-4-(2-morpholin-4-ylethylamino)benzenesulfonamide
CID 43453904
3-fluoro-4-methyl-N-(2-morpholin-4-ylethyl)aniline
CID 28583324
3-chloro-4-methyl-N-(2-morpholin-4-ylethyl)aniline
CID 28568493
N-[3-[2-hydroxy-3-[(4-morpholin-4-ylphenyl)iminomethyl]-1H-indole-5-carbonyl]phenyl]acetamide
CID 135441376
4-chloro-N-(2-morpholin-4-ylethyl)aniline
CID 28580807
3-bromo-4-methyl-N-(2-morpholin-4-ylethyl)aniline
CID 39420305
1-N-decyl-3-N-(2-morpholin-4-ylethyl)benzene-1,3-diamine
CID 151335568

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol?
The IUPAC name of 4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol (CID 135605299) is 4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol.
What is the SMILES notation for 4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol?
The canonical SMILES for 4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol is Cc1cccc2[nH]c(O)c(/C=N/c3ccc(NCCN4CCOCC4)cc3)c12.
What is the InChIKey of 4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol?
The InChIKey is SOUKQXOQNVGXNZ-BUVRLJJBSA-N. The full InChI is InChI=1S/C22H26N4O2/c1-16-3-2-4-20-21(16)19(22(27)25-20)15-24-18-7-5-17(6-8-18)23-9-10-26-11-13-28-14-12-26/h2-8,15,23,25,27H,9-14H2,1H3/b24-15+.
What are the key properties of 4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol?
4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol has a molecular weight of 378.48 g/mol, XLogP of 3.68, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-[[4-(2-morpholin-4-ylethylamino)phenyl]iminomethyl]-1H-indol-2-ol is sourced from PubChem (CID 135605299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).