1-ethylindole-2-carbohydrazide

C11H13N3O — CID 166595239

IUPAC1-ethylindole-2-carbohydrazide
SMILESCCn1c(C(=O)NN)cc2ccccc21
InChIInChI=1S/C11H13N3O/c1-2-14-9-6-4-3-5-8(9)7-10(14)11(15)13-12/h3-7H,2,12H2,1H3,(H,13,15)
InChIKeyTYCDJBOEIQILCN-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.26
Rot. Bonds2

About 1-ethylindole-2-carbohydrazide

1-ethylindole-2-carbohydrazide (PubChem CID 166595239) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 1-ethylindole-2-carbohydrazide.

Molecular Properties

Compound Name1-ethylindole-2-carbohydrazide
PubChem CID166595239
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name1-ethylindole-2-carbohydrazide
SMILESCCn1c(C(=O)NN)cc2ccccc21
InChIInChI=1S/C11H13N3O/c1-2-14-9-6-4-3-5-8(9)7-10(14)11(15)13-12/h3-7H,2,12H2,1H3,(H,13,15)
InChIKeyTYCDJBOEIQILCN-UHFFFAOYSA-N
XLogP1.26
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-ethyl-N-prop-2-ynylindole-2-carboxamide
CID 47335095
methyl 2-[(1-ethylindole-2-carbonyl)amino]-3-methylbutanoate
CID 86845751
N-[3-(dimethylamino)-3-oxopropyl]-1-ethylindole-2-carboxamide
CID 47066990
methyl 2-[(1-ethylindole-2-carbonyl)amino]-4-methylpentanoate
CID 60550495
1-ethyl-N-[2-(2-methoxyethylamino)-2-oxoethyl]indole-2-carboxamide
CID 60550859
1-ethyl-N-(1,3-thiazol-2-yl)indole-2-carboxamide
CID 47335050
1-ethyl-N-[[1-(1-hydroxy-2-methylpropyl)cyclopropyl]methyl]indole-2-carboxamide
CID 75444716
4-(1-ethylindol-2-yl)-4-hydroxy-2-oxobut-3-enoic acid
CID 3012072
1-ethyl-N-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]indole-2-carboxamide
CID 52522890
1-ethyl-N'-[3-(trifluoromethyl)phenyl]indole-2-carbohydrazide
CID 56519892
2-(1-ethylindol-2-yl)acetamide
CID 67469018
CID 160990756
CID 160990756

Frequently Asked Questions

What is the IUPAC name of 1-ethylindole-2-carbohydrazide?
The IUPAC name of 1-ethylindole-2-carbohydrazide (CID 166595239) is 1-ethylindole-2-carbohydrazide.
What is the SMILES notation for 1-ethylindole-2-carbohydrazide?
The canonical SMILES for 1-ethylindole-2-carbohydrazide is CCn1c(C(=O)NN)cc2ccccc21.
What is the InChIKey of 1-ethylindole-2-carbohydrazide?
The InChIKey is TYCDJBOEIQILCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-2-14-9-6-4-3-5-8(9)7-10(14)11(15)13-12/h3-7H,2,12H2,1H3,(H,13,15).
What are the key properties of 1-ethylindole-2-carbohydrazide?
1-ethylindole-2-carbohydrazide has a molecular weight of 203.25 g/mol, XLogP of 1.26, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethylindole-2-carbohydrazide is sourced from PubChem (CID 166595239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).