N'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide

C20H23N3O4 — CID 4599962

IUPACN'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide
SMILESCCOc1ccccc1OCC(=O)NNCC(=O)N1CCc2ccccc21
InChIInChI=1S/C20H23N3O4/c1-2-26-17-9-5-6-10-18(17)27-14-19(24)22-21-13-20(25)23-12-11-15-7-3-4-8-16(15)23/h3-10,21H,2,11-14H2,1H3,(H,22,24)
InChIKeyUVGZDQDJHVLQFW-UHFFFAOYSA-N
MW369.42 g/mol
LogP1.67
Rot. Bonds8

About N'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide

N'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide (PubChem CID 4599962) has the molecular formula C20H23N3O4 and a molecular weight of 369.42 g/mol. Its IUPAC name is N'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide.

Molecular Properties

Compound NameN'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide
PubChem CID4599962
Molecular FormulaC20H23N3O4
Molecular Weight369.42 g/mol
Exact Mass369.17
IUPAC NameN'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide
SMILESCCOc1ccccc1OCC(=O)NNCC(=O)N1CCc2ccccc21
InChIInChI=1S/C20H23N3O4/c1-2-26-17-9-5-6-10-18(17)27-14-19(24)22-21-13-20(25)23-12-11-15-7-3-4-8-16(15)23/h3-10,21H,2,11-14H2,1H3,(H,22,24)
InChIKeyUVGZDQDJHVLQFW-UHFFFAOYSA-N
XLogP1.67
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-(2,3-dihydroindol-1-yl)-2-[2-(2-ethoxyethoxy)anilino]ethanone
CID 54827531
N-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]propanamide
CID 47413298
2-(2-ethoxyphenoxy)-1-(4-methyl-3,5-dihydro-2H-1,4-benzodiazepin-1-yl)ethanone
CID 167894695
2-(2-butoxyanilino)-1-(2,3-dihydroindol-1-yl)ethanone
CID 54827804
1-(2,3-dihydroindol-1-yl)-2-(2-methoxyanilino)ethanone
CID 9080490
2-(2-chlorophenoxy)-1-(2,3-dihydroindol-1-yl)ethanone
CID 823401
2-(2,5-dichlorophenoxy)-N-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]acetamide
CID 110615297
[2-(3,4-diethoxyanilino)-2-oxoethyl]-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-methylazanium
CID 8818636
1-(2,3-dihydroindol-1-yl)-2-[2-(2,3-dihydroindol-1-yl)-2-oxoethoxy]ethanone
CID 3405769
2-[6-(2,3-dihydroindole-1-carbonyl)-4-oxopyran-3-yl]oxy-N-(2-ethoxyphenyl)acetamide
CID 30864833
methyl 3-(2,3-dihydroindol-1-yl)-3-oxopropanoate
CID 8990559
2-[4-(2,3-dihydroindole-1-carbonyl)-2-ethoxyphenoxy]-1-morpholin-4-ylethanone
CID 8012463

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide?
The IUPAC name of N'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide (CID 4599962) is N'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide.
What is the SMILES notation for N'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide?
The canonical SMILES for N'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide is CCOc1ccccc1OCC(=O)NNCC(=O)N1CCc2ccccc21.
What is the InChIKey of N'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide?
The InChIKey is UVGZDQDJHVLQFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O4/c1-2-26-17-9-5-6-10-18(17)27-14-19(24)22-21-13-20(25)23-12-11-15-7-3-4-8-16(15)23/h3-10,21H,2,11-14H2,1H3,(H,22,24).
What are the key properties of N'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide?
N'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide has a molecular weight of 369.42 g/mol, XLogP of 1.67, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(2-ethoxyphenoxy)acetohydrazide is sourced from PubChem (CID 4599962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).