5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide

C19H19N3O3 — CID 6885743

IUPAC5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide
SMILESCCOc1ccc2[nH]c(C(=O)N/N=C/c3cccc(OC)c3)cc2c1
InChIInChI=1S/C19H19N3O3/c1-3-25-16-7-8-17-14(10-16)11-18(21-17)19(23)22-20-12-13-5-4-6-15(9-13)24-2/h4-12,21H,3H2,1-2H3,(H,22,23)/b20-12+
InChIKeyAQMRKWZLQZBUHR-UDWIEESQSA-N
MW337.38 g/mol
LogP3.34
Rot. Bonds6

About 5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide

5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide (PubChem CID 6885743) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is 5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide.

Molecular Properties

Compound Name5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide
PubChem CID6885743
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide
SMILESCCOc1ccc2[nH]c(C(=O)N/N=C/c3cccc(OC)c3)cc2c1
InChIInChI=1S/C19H19N3O3/c1-3-25-16-7-8-17-14(10-16)11-18(21-17)19(23)22-20-12-13-5-4-6-15(9-13)24-2/h4-12,21H,3H2,1-2H3,(H,22,23)/b20-12+
InChIKeyAQMRKWZLQZBUHR-UDWIEESQSA-N
XLogP3.34
TPSA75.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-ethoxy-N-[(Z)-(2-hydroxy-3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide
CID 136792738
N-[(E)-(4-ethoxyphenyl)methylideneamino]-6-methoxy-1H-indole-2-carboxamide
CID 6885107
N-[(2-fluorophenyl)methylideneamino]-5-methoxy-1H-indole-2-carboxamide
CID 156600169
N-[(E)-(4-fluoro-3-methoxyphenyl)methylideneamino]-5-[2-[(2E)-2-[(4-fluoro-3-methoxyphenyl)methylidene]hydrazinyl]-2-oxoethoxy]-1H-indole-2-carboxamide
CID 44621337
N-[(3-nitrophenyl)methylideneamino]-5-phenylmethoxy-1H-indole-2-carboxamide
CID 3889062
4-ethoxy-N-[(E)-(3-propoxyphenyl)methylideneamino]benzamide
CID 17246375
N-[(Z)-(3-ethoxyphenyl)methylideneamino]pyridine-2-carboxamide
CID 40618803
N-[(E)-(4-ethoxyphenyl)methylideneamino]-4,5,6-trimethoxy-1H-indole-2-carboxamide
CID 6878850
5-bromo-2-ethoxy-N-[(3-methoxyphenyl)methylideneamino]benzamide
CID 71960212
1,3-bis[(Z)-(3-methoxyphenyl)methylideneamino]urea
CID 5414266
N-[(E)-(3-ethoxyphenyl)methylideneamino]pyrazine-2-carboxamide
CID 44613929
ethyl 2-[3-[(E)-[(4-ethoxybenzoyl)hydrazinylidene]methyl]phenoxy]acetate
CID 17246379

Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide?
The IUPAC name of 5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide (CID 6885743) is 5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide.
What is the SMILES notation for 5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide?
The canonical SMILES for 5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide is CCOc1ccc2[nH]c(C(=O)N/N=C/c3cccc(OC)c3)cc2c1.
What is the InChIKey of 5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide?
The InChIKey is AQMRKWZLQZBUHR-UDWIEESQSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-3-25-16-7-8-17-14(10-16)11-18(21-17)19(23)22-20-12-13-5-4-6-15(9-13)24-2/h4-12,21H,3H2,1-2H3,(H,22,23)/b20-12+.
What are the key properties of 5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide?
5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide has a molecular weight of 337.38 g/mol, XLogP of 3.34, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-N-[(E)-(3-methoxyphenyl)methylideneamino]-1H-indole-2-carboxamide is sourced from PubChem (CID 6885743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).