[3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine

C16H25F3N2 — CID 105299684

IUPAC[3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine
SMILESCCCCC(CC)C(Cc1ccc(C(F)(F)F)cc1)NN
InChIInChI=1S/C16H25F3N2/c1-3-5-6-13(4-2)15(21-20)11-12-7-9-14(10-8-12)16(17,18)19/h7-10,13,15,21H,3-6,11,20H2,1-2H3
InChIKeyOUXZAMOCEUUTQC-UHFFFAOYSA-N
MW302.38 g/mol
LogP4.30
Rot. Bonds8

About [3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine

[3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine (PubChem CID 105299684) has the molecular formula C16H25F3N2 and a molecular weight of 302.38 g/mol. Its IUPAC name is [3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine.

Molecular Properties

Compound Name[3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine
PubChem CID105299684
Molecular FormulaC16H25F3N2
Molecular Weight302.38 g/mol
Exact Mass302.20
IUPAC Name[3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine
SMILESCCCCC(CC)C(Cc1ccc(C(F)(F)F)cc1)NN
InChIInChI=1S/C16H25F3N2/c1-3-5-6-13(4-2)15(21-20)11-12-7-9-14(10-8-12)16(17,18)19/h7-10,13,15,21H,3-6,11,20H2,1-2H3
InChIKeyOUXZAMOCEUUTQC-UHFFFAOYSA-N
XLogP4.30
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 54.30
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

[3-ethyl-1-(4-propan-2-ylphenyl)heptan-2-yl]hydrazine
CID 105297263
1-(2-bromo-3-ethylheptyl)-4-(trifluoromethyl)benzene
CID 63529882
N-methyl-1-[4-(trifluoromethyl)phenyl]hexan-2-amine
CID 55040773
[3-ethyl-1-(3-fluoro-4-methoxyphenyl)heptan-2-yl]hydrazine
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N-methyl-3-propyl-1-[4-(trifluoromethyl)phenyl]hexan-2-amine
CID 82989467
[1-(3-bromophenyl)-3-ethylheptan-2-yl]hydrazine
CID 105284555
(2S)-1-[4-[4-(trifluoromethyl)phenyl]phenyl]hexan-2-amine
CID 146224491
[3-ethyl-1-(4-fluorophenyl)pentan-2-yl]hydrazine
CID 105198180
1-[4-(trifluoromethyl)phenyl]decan-2-amine
CID 65426535
N-methyl-1-[4-(trifluoromethyl)phenyl]octan-2-amine
CID 114752994
[5-methoxy-3-methyl-1-[4-(trifluoromethyl)phenyl]pentan-2-yl]hydrazine
CID 105337979
[1-(4-fluorophenyl)-3-propylhexan-2-yl]hydrazine
CID 105283723

Frequently Asked Questions

What is the IUPAC name of [3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine?
The IUPAC name of [3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine (CID 105299684) is [3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine.
What is the SMILES notation for [3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine?
The canonical SMILES for [3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine is CCCCC(CC)C(Cc1ccc(C(F)(F)F)cc1)NN.
What is the InChIKey of [3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine?
The InChIKey is OUXZAMOCEUUTQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25F3N2/c1-3-5-6-13(4-2)15(21-20)11-12-7-9-14(10-8-12)16(17,18)19/h7-10,13,15,21H,3-6,11,20H2,1-2H3.
What are the key properties of [3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine?
[3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine has a molecular weight of 302.38 g/mol, XLogP of 4.30, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-ethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-yl]hydrazine is sourced from PubChem (CID 105299684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).