4-fluoro-1-methyl-2-methylidenepiperazine

Name: 4-fluoro-1-methyl-2-methylidenepiperazine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₆H₁₁FN₂ — CID 156747861

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC4-fluoro-1-methyl-2-methylidenepiperazine

SMILESC=C1CN(F)CCN1C

InChIInChI=1S/C6H11FN2/c1-6-5-9(7)4-3-8(6)2/h1,3-5H2,2H3

InChIKeyGJUAPHXEQFQITP-UHFFFAOYSA-N

MW130.17 g/mol

LogP0.63

Rot. Bonds

About 4-fluoro-1-methyl-2-methylidenepiperazine

4-fluoro-1-methyl-2-methylidenepiperazine (PubChem CID 156747861) has the molecular formula C₆H₁₁FN₂ and a molecular weight of 130.17 g/mol. Its IUPAC name is 4-fluoro-1-methyl-2-methylidenepiperazine.

Molecular Properties

Compound Name	4-fluoro-1-methyl-2-methylidenepiperazine
PubChem CID	156747861
Molecular Formula	C₆H₁₁FN₂
Molecular Weight	130.17 g/mol
Exact Mass	130.09
IUPAC Name	4-fluoro-1-methyl-2-methylidenepiperazine
SMILES	C=C1CN(F)CCN1C
InChI	InChI=1S/C6H11FN2/c1-6-5-9(7)4-3-8(6)2/h1,3-5H2,2H3
InChIKey	GJUAPHXEQFQITP-UHFFFAOYSA-N
XLogP	0.63
TPSA	6.48 Å²
H-Bond Donors
H-Bond Acceptors	2
Rotatable Bonds
Heavy Atoms	9
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	130.17
LogP ≤ 5	0.63
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-methyl-2-methylidenepiperazine?

The IUPAC name of 4-fluoro-1-methyl-2-methylidenepiperazine (CID 156747861) is 4-fluoro-1-methyl-2-methylidenepiperazine.

What is the SMILES notation for 4-fluoro-1-methyl-2-methylidenepiperazine?

The canonical SMILES for 4-fluoro-1-methyl-2-methylidenepiperazine is C=C1CN(F)CCN1C.

What is the InChIKey of 4-fluoro-1-methyl-2-methylidenepiperazine?

The InChIKey is GJUAPHXEQFQITP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11FN2/c1-6-5-9(7)4-3-8(6)2/h1,3-5H2,2H3.

What are the key properties of 4-fluoro-1-methyl-2-methylidenepiperazine?

4-fluoro-1-methyl-2-methylidenepiperazine has a molecular weight of 130.17 g/mol, XLogP of 0.63, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 4-fluoro-1-methyl-2-methylidenepiperazine is sourced from PubChem (CID 156747861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 156747861 — identifiers, structure, computed properties (public domain)

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