N-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide

C20H28N4O4 — CID 135924645

IUPACN-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide
SMILESCCCCCn1c(O)c(/N=N/C(=O)CN2CCOCC2)c2ccc(OC)cc21
InChIInChI=1S/C20H28N4O4/c1-3-4-5-8-24-17-13-15(27-2)6-7-16(17)19(20(24)26)22-21-18(25)14-23-9-11-28-12-10-23/h6-7,13,26H,3-5,8-12,14H2,1-2H3/b22-21+
InChIKeyUHHAZCDRVQJHRE-QURGRASLSA-N
MW388.47 g/mol
LogP3.49
Rot. Bonds8

About N-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide

N-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide (PubChem CID 135924645) has the molecular formula C20H28N4O4 and a molecular weight of 388.47 g/mol. Its IUPAC name is N-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide
PubChem CID135924645
Molecular FormulaC20H28N4O4
Molecular Weight388.47 g/mol
Exact Mass388.21
IUPAC NameN-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide
SMILESCCCCCn1c(O)c(/N=N/C(=O)CN2CCOCC2)c2ccc(OC)cc21
InChIInChI=1S/C20H28N4O4/c1-3-4-5-8-24-17-13-15(27-2)6-7-16(17)19(20(24)26)22-21-18(25)14-23-9-11-28-12-10-23/h6-7,13,26H,3-5,8-12,14H2,1-2H3/b22-21+
InChIKeyUHHAZCDRVQJHRE-QURGRASLSA-N
XLogP3.49
TPSA88.65 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze N-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide 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

(E)-methyl 2-(1-(2-ethoxy-2-oxoethyl)-2-oxoindolin-3-ylidene)hydrazinecarboxylate
CID 939662
N'-[(3Z)-1-Hexyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-4-methoxybenzohydrazide
CID 135881484
N'-[(3Z)-1-Hexyl-6-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene]benzohydrazide
CID 135924633
N'-[(3Z)-6-Methoxy-1-pentyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]benzohydrazide
CID 135924634
N'-[(3Z)-1-Butyl-6-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene]benzohydrazide
CID 135924635
N'-[(3Z)-1-(Cyclohexylmethyl)-6-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene]benzohydrazide
CID 135924636
N'-[(3Z)-1-Benzyl-6-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene]benzohydrazide
CID 135924637
N'-[(3Z)-1-(2-Cyclohexylethyl)-6-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene]benzohydrazide
CID 135924638
N'-[(3Z)-6-methoxy-1-(2-methoxyethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]benzohydrazide
CID 135924639
N'-[(3Z)-6-Methoxy-1-pentyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]cyclohexanecarbohydrazide
CID 135924640
2-Hydroxy-N'-[(3Z)-6-methoxy-1-pentyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2-methylpropanohydrazide
CID 135924641
tert-butyl (2Z)-2-(6-methoxy-1-pentyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinecarboxylate
CID 135924642

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide?
The IUPAC name of N-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide (CID 135924645) is N-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide?
The canonical SMILES for N-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide is CCCCCn1c(O)c(/N=N/C(=O)CN2CCOCC2)c2ccc(OC)cc21.
What is the InChIKey of N-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide?
The InChIKey is UHHAZCDRVQJHRE-QURGRASLSA-N. The full InChI is InChI=1S/C20H28N4O4/c1-3-4-5-8-24-17-13-15(27-2)6-7-16(17)19(20(24)26)22-21-18(25)14-23-9-11-28-12-10-23/h6-7,13,26H,3-5,8-12,14H2,1-2H3/b22-21+.
What are the key properties of N-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide?
N-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide has a molecular weight of 388.47 g/mol, XLogP of 3.49, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-6-methoxy-1-pentylindol-3-yl)imino-2-morpholin-4-ylacetamide is sourced from PubChem (CID 135924645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).