4-fluoro-1-methyl-2-methylidenepiperazine

C6H11FN2 — CID 156747861

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 Name4-fluoro-1-methyl-2-methylidenepiperazine
PubChem CID156747861
Molecular FormulaC6H11FN2
Molecular Weight130.17 g/mol
Exact Mass130.09
IUPAC Name4-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
XLogP0.63
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.17
LogP ≤ 50.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(3-Fluorobuta-1,3-dien-2-yl)-4-methylpiperazine
CID 123346502
1,4-Dimethyl-2,3-dimethylidenepiperazine
CID 12840741
1-Ethyl-4-prop-1-en-2-ylpiperazine
CID 20829762
1-Methyl-4-prop-1-en-2-ylpiperazine
CID 21366497
1,4-Dimethyl-2-methylidenepiperazine
CID 54488727
1-Methyl-2-methylidene-4-propan-2-ylpiperazine
CID 58548422
1-Ethyl-4-methyl-2-methylidenepiperazine
CID 58871661
1,4-Bis(prop-1-en-2-yl)piperazine
CID 59955120
2-Methylidene-1,4-di(propan-2-yl)piperazine
CID 68267223
1-Ethyl-2-methylidene-4-propan-2-ylpiperazine
CID 89321143
Ethane;1-ethyl-4-methyl-2-methylidenepiperazine
CID 91069058
2-Ethenylidene-1,4-dimethylpiperazine
CID 118519406

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).