1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine

C11H17N3 — CID 154587507

IUPAC1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine
SMILESCNNCC1=CC2CC=CC=C2N1C
InChIInChI=1S/C11H17N3/c1-12-13-8-10-7-9-5-3-4-6-11(9)14(10)2/h3-4,6-7,9,12-13H,5,8H2,1-2H3
InChIKeyXMTDTJLVGPVIAZ-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.00
Rot. Bonds3

About 1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine

1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine (PubChem CID 154587507) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine
PubChem CID154587507
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine
SMILESCNNCC1=CC2CC=CC=C2N1C
InChIInChI=1S/C11H17N3/c1-12-13-8-10-7-9-5-3-4-6-11(9)14(10)2/h3-4,6-7,9,12-13H,5,8H2,1-2H3
InChIKeyXMTDTJLVGPVIAZ-UHFFFAOYSA-N
XLogP1.00
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine?
The IUPAC name of 1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine (CID 154587507) is 1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine.
What is the SMILES notation for 1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine?
The canonical SMILES for 1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine is CNNCC1=CC2CC=CC=C2N1C.
What is the InChIKey of 1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine?
The InChIKey is XMTDTJLVGPVIAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-12-13-8-10-7-9-5-3-4-6-11(9)14(10)2/h3-4,6-7,9,12-13H,5,8H2,1-2H3.
What are the key properties of 1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine?
1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine has a molecular weight of 191.28 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[(1-methyl-3a,4-dihydroindol-2-yl)methyl]hydrazine is sourced from PubChem (CID 154587507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).