1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine

C15H31FN2 — CID 134239933

IUPAC1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine
SMILESCCNNCC(C)C/C(C)=C/CCCC(F)CC
InChIInChI=1S/C15H31FN2/c1-5-15(16)10-8-7-9-13(3)11-14(4)12-18-17-6-2/h9,14-15,17-18H,5-8,10-12H2,1-4H3/b13-9+
InChIKeyPGTFMHDQPWRQHE-UKTHLTGXSA-N
MW258.42 g/mol
LogP3.99
Rot. Bonds11

About 1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine

1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine (PubChem CID 134239933) has the molecular formula C15H31FN2 and a molecular weight of 258.42 g/mol. Its IUPAC name is 1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine.

Molecular Properties

Compound Name1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine
PubChem CID134239933
Molecular FormulaC15H31FN2
Molecular Weight258.42 g/mol
Exact Mass258.25
IUPAC Name1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine
SMILESCCNNCC(C)C/C(C)=C/CCCC(F)CC
InChIInChI=1S/C15H31FN2/c1-5-15(16)10-8-7-9-13(3)11-14(4)12-18-17-6-2/h9,14-15,17-18H,5-8,10-12H2,1-4H3/b13-9+
InChIKeyPGTFMHDQPWRQHE-UKTHLTGXSA-N
XLogP3.99
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.42
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(E)-3,5-dimethyldec-5-enoic acid
CID 87825875
N,4,6-trimethylnon-3-en-1-amine
CID 79599077
N-tert-butyl-4,6-dimethyloct-3-en-1-amine
CID 79607887
2,3,8-trimethyldec-3-ene
CID 123648225
N-(4,6-dimethyloct-3-enyl)cyclopropanamine
CID 79598638
7,11-dimethyltridec-6-ene
CID 91025564
N-(2-methoxyethyl)-4,6-dimethyloct-3-en-1-amine
CID 79607917
[[(Z)-7-fluoro-2-methyloct-6-enyl]amino]methanol
CID 144991147
6-ethyl-4-methyl-N-(2-methylpropyl)oct-3-en-1-amine
CID 82935709
N-(4,6-dimethylnon-3-enyl)cyclopropanamine
CID 79606790
2,7-dimethyldec-2-ene
CID 123304905
(E)-14-fluoro-6-methylhexadec-6-en-8-yne
CID 178162842

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine?
The IUPAC name of 1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine (CID 134239933) is 1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine.
What is the SMILES notation for 1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine?
The canonical SMILES for 1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine is CCNNCC(C)C/C(C)=C/CCCC(F)CC.
What is the InChIKey of 1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine?
The InChIKey is PGTFMHDQPWRQHE-UKTHLTGXSA-N. The full InChI is InChI=1S/C15H31FN2/c1-5-15(16)10-8-7-9-13(3)11-14(4)12-18-17-6-2/h9,14-15,17-18H,5-8,10-12H2,1-4H3/b13-9+.
What are the key properties of 1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine?
1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine has a molecular weight of 258.42 g/mol, XLogP of 3.99, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-[(E)-9-fluoro-2,4-dimethylundec-4-enyl]hydrazine is sourced from PubChem (CID 134239933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).