(3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine

C11H17N3 — CID 137183049

IUPAC(3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine
SMILESCCc1c(C)[nH]c2c1C(=NN)CCC2
InChIInChI=1S/C11H17N3/c1-3-8-7(2)13-9-5-4-6-10(14-12)11(8)9/h13H,3-6,12H2,1-2H3
InChIKeyHOUKUSRKSWFHPX-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.88
Rot. Bonds1

About (3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine

(3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine (PubChem CID 137183049) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is (3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine.

Molecular Properties

Compound Name(3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine
PubChem CID137183049
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name(3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine
SMILESCCc1c(C)[nH]c2c1C(=NN)CCC2
InChIInChI=1S/C11H17N3/c1-3-8-7(2)13-9-5-4-6-10(14-12)11(8)9/h13H,3-6,12H2,1-2H3
InChIKeyHOUKUSRKSWFHPX-UHFFFAOYSA-N
XLogP1.88
TPSA54.17 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine?
The IUPAC name of (3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine (CID 137183049) is (3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine.
What is the SMILES notation for (3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine?
The canonical SMILES for (3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine is CCc1c(C)[nH]c2c1C(=NN)CCC2.
What is the InChIKey of (3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine?
The InChIKey is HOUKUSRKSWFHPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-3-8-7(2)13-9-5-4-6-10(14-12)11(8)9/h13H,3-6,12H2,1-2H3.
What are the key properties of (3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine?
(3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine has a molecular weight of 191.28 g/mol, XLogP of 1.88, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethyl-2-methyl-1,5,6,7-tetrahydroindol-4-ylidene)hydrazine is sourced from PubChem (CID 137183049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).