[1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine

C16H26FN3 — CID 105241230

IUPAC[1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine
SMILESCCC(C)(C(NN)c1cc(C)cc(F)c1)N1CCCC1
InChIInChI=1S/C16H26FN3/c1-4-16(3,20-7-5-6-8-20)15(19-18)13-9-12(2)10-14(17)11-13/h9-11,15,19H,4-8,18H2,1-3H3
InChIKeyGFKARMBWOJIPBY-UHFFFAOYSA-N
MW279.40 g/mol
LogP2.90
Rot. Bonds5

About [1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine

[1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine (PubChem CID 105241230) has the molecular formula C16H26FN3 and a molecular weight of 279.40 g/mol. Its IUPAC name is [1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine
PubChem CID105241230
Molecular FormulaC16H26FN3
Molecular Weight279.40 g/mol
Exact Mass279.21
IUPAC Name[1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine
SMILESCCC(C)(C(NN)c1cc(C)cc(F)c1)N1CCCC1
InChIInChI=1S/C16H26FN3/c1-4-16(3,20-7-5-6-8-20)15(19-18)13-9-12(2)10-14(17)11-13/h9-11,15,19H,4-8,18H2,1-3H3
InChIKeyGFKARMBWOJIPBY-UHFFFAOYSA-N
XLogP2.90
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.40
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[1-(3,5-dimethylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine
CID 105241209
1-(3-fluoro-5-methylphenyl)-2-methyl-2-piperidin-1-ylbutan-1-amine
CID 79705436
1-(3-fluoro-5-methylphenyl)-2-methyl-2-piperidin-1-ylbutan-1-ol
CID 79704324
[1-(3-fluoro-5-methylphenyl)-2,2-dimethylbutyl]hydrazine
CID 105325387
[1-(2,4-difluorophenyl)-2-methyl-2-piperidin-1-ylbutyl]hydrazine
CID 105241349
[2-methyl-2-pyrrolidin-1-yl-1-(2,4,5-trimethylphenyl)butyl]hydrazine
CID 105241178
[1-(4-ethylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine
CID 105241199
[1-(5-bromo-2-fluorophenyl)-2-methyl-2-piperidin-1-ylbutyl]hydrazine
CID 105241371
[1-(furan-3-yl)-2-methyl-2-piperidin-1-ylbutyl]hydrazine
CID 105241401
1-(3,5-dimethylphenyl)-2-methyl-2-piperidin-1-ylbutan-1-amine
CID 79065290
[1-(2-fluoro-4-methoxyphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine
CID 103397603
[1-(4-methoxyphenyl)-2-methyl-2-piperidin-1-ylbutyl]hydrazine
CID 105241337

Frequently Asked Questions

What is the IUPAC name of [1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine?
The IUPAC name of [1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine (CID 105241230) is [1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine.
What is the SMILES notation for [1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine?
The canonical SMILES for [1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine is CCC(C)(C(NN)c1cc(C)cc(F)c1)N1CCCC1.
What is the InChIKey of [1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine?
The InChIKey is GFKARMBWOJIPBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26FN3/c1-4-16(3,20-7-5-6-8-20)15(19-18)13-9-12(2)10-14(17)11-13/h9-11,15,19H,4-8,18H2,1-3H3.
What are the key properties of [1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine?
[1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine has a molecular weight of 279.40 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-fluoro-5-methylphenyl)-2-methyl-2-pyrrolidin-1-ylbutyl]hydrazine is sourced from PubChem (CID 105241230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).