[1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine

C15H24ClFN2 — CID 102868832

IUPAC[1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine
SMILESCCCCC(CC)C(Cc1cccc(Cl)c1F)NN
InChIInChI=1S/C15H24ClFN2/c1-3-5-7-11(4-2)14(19-18)10-12-8-6-9-13(16)15(12)17/h6,8-9,11,14,19H,3-5,7,10,18H2,1-2H3
InChIKeyJWDUWLXKBWEARV-UHFFFAOYSA-N
MW286.82 g/mol
LogP4.07
Rot. Bonds8

About [1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine

[1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine (PubChem CID 102868832) has the molecular formula C15H24ClFN2 and a molecular weight of 286.82 g/mol. Its IUPAC name is [1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine
PubChem CID102868832
Molecular FormulaC15H24ClFN2
Molecular Weight286.82 g/mol
Exact Mass286.16
IUPAC Name[1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine
SMILESCCCCC(CC)C(Cc1cccc(Cl)c1F)NN
InChIInChI=1S/C15H24ClFN2/c1-3-5-7-11(4-2)14(19-18)10-12-8-6-9-13(16)15(12)17/h6,8-9,11,14,19H,3-5,7,10,18H2,1-2H3
InChIKeyJWDUWLXKBWEARV-UHFFFAOYSA-N
XLogP4.07
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.82
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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-(4-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine
CID 105342705
1-(3-chloro-2-fluorophenyl)-N-ethyl-3-propylhexan-2-amine
CID 102867344
1-(3-chloro-2-fluorophenyl)-N-methylheptan-2-amine
CID 82805674
1-(3-chloro-2-fluorophenyl)dodecan-2-amine
CID 82789502
1-(3-chloro-2-fluorophenyl)octan-2-amine
CID 82806578
1-(3-chloro-2-fluorophenyl)-N-methylundecan-2-amine
CID 82789169
[1-(2-bromo-4-fluorophenyl)-3-ethylheptan-2-yl]hydrazine
CID 105296661
[1-(3-chloro-2-fluorophenyl)-3-cyclopropylbutan-2-yl]hydrazine
CID 102868874
[1-(2-chloro-6-fluorophenyl)-3-ethylpentan-2-yl]hydrazine
CID 105215890
1-(3-chloro-2-fluorophenyl)-N-ethylheptan-2-amine
CID 82806799
1-(2-chloro-5-fluorophenyl)-N,3-diethylheptan-2-amine
CID 102622959
3-ethyl-1-(2-fluorophenyl)-N-methylheptan-2-amine
CID 63527234

Frequently Asked Questions

What is the IUPAC name of [1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine?
The IUPAC name of [1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine (CID 102868832) is [1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine.
What is the SMILES notation for [1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine?
The canonical SMILES for [1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine is CCCCC(CC)C(Cc1cccc(Cl)c1F)NN.
What is the InChIKey of [1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine?
The InChIKey is JWDUWLXKBWEARV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24ClFN2/c1-3-5-7-11(4-2)14(19-18)10-12-8-6-9-13(16)15(12)17/h6,8-9,11,14,19H,3-5,7,10,18H2,1-2H3.
What are the key properties of [1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine?
[1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine has a molecular weight of 286.82 g/mol, XLogP of 4.07, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chloro-2-fluorophenyl)-3-ethylheptan-2-yl]hydrazine is sourced from PubChem (CID 102868832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).