[3-(10,10,10-trifluorodecyl)phenoxy]hydrazine

C16H25F3N2O — CID 151391312

IUPAC[3-(10,10,10-trifluorodecyl)phenoxy]hydrazine
SMILESNNOc1cccc(CCCCCCCCCC(F)(F)F)c1
InChIInChI=1S/C16H25F3N2O/c17-16(18,19)12-7-5-3-1-2-4-6-9-14-10-8-11-15(13-14)22-21-20/h8,10-11,13,21H,1-7,9,12,20H2
InChIKeyOUMRULMCTHEQSP-UHFFFAOYSA-N
MW318.38 g/mol
LogP4.67
Rot. Bonds11

About [3-(10,10,10-trifluorodecyl)phenoxy]hydrazine

[3-(10,10,10-trifluorodecyl)phenoxy]hydrazine (PubChem CID 151391312) has the molecular formula C16H25F3N2O and a molecular weight of 318.38 g/mol. Its IUPAC name is [3-(10,10,10-trifluorodecyl)phenoxy]hydrazine.

Molecular Properties

Compound Name[3-(10,10,10-trifluorodecyl)phenoxy]hydrazine
PubChem CID151391312
Molecular FormulaC16H25F3N2O
Molecular Weight318.38 g/mol
Exact Mass318.19
IUPAC Name[3-(10,10,10-trifluorodecyl)phenoxy]hydrazine
SMILESNNOc1cccc(CCCCCCCCCC(F)(F)F)c1
InChIInChI=1S/C16H25F3N2O/c17-16(18,19)12-7-5-3-1-2-4-6-9-14-10-8-11-15(13-14)22-21-20/h8,10-11,13,21H,1-7,9,12,20H2
InChIKeyOUMRULMCTHEQSP-UHFFFAOYSA-N
XLogP4.67
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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CID 151183417
[3-(4-aminobutyl)phenyl] trifluoromethanesulfonate
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CID 59545774
6-(10,10,10-trifluorodecyl)pyridin-2-amine
CID 151361803
2-(4,4,4-trifluorobutyl)naphthalene
CID 91307122
5-(3-phenoxyphenyl)pentan-1-amine
CID 175525700
1-butyl-3-(trifluoromethoxy)benzene
CID 57030134
3-[3-(trifluoromethoxy)phenyl]propan-1-ol
CID 53434391
1-(difluoromethoxy)-4-[3-(4,4,4-trifluorobutyl)phenyl]benzene
CID 70299409
1-bromo-3-(10,10,10-trifluorodecoxy)benzene
CID 151626696
1-methoxy-3-nonadecylbenzene
CID 154507578
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CID 70229700

Frequently Asked Questions

What is the IUPAC name of [3-(10,10,10-trifluorodecyl)phenoxy]hydrazine?
The IUPAC name of [3-(10,10,10-trifluorodecyl)phenoxy]hydrazine (CID 151391312) is [3-(10,10,10-trifluorodecyl)phenoxy]hydrazine.
What is the SMILES notation for [3-(10,10,10-trifluorodecyl)phenoxy]hydrazine?
The canonical SMILES for [3-(10,10,10-trifluorodecyl)phenoxy]hydrazine is NNOc1cccc(CCCCCCCCCC(F)(F)F)c1.
What is the InChIKey of [3-(10,10,10-trifluorodecyl)phenoxy]hydrazine?
The InChIKey is OUMRULMCTHEQSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25F3N2O/c17-16(18,19)12-7-5-3-1-2-4-6-9-14-10-8-11-15(13-14)22-21-20/h8,10-11,13,21H,1-7,9,12,20H2.
What are the key properties of [3-(10,10,10-trifluorodecyl)phenoxy]hydrazine?
[3-(10,10,10-trifluorodecyl)phenoxy]hydrazine has a molecular weight of 318.38 g/mol, XLogP of 4.67, 11 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(10,10,10-trifluorodecyl)phenoxy]hydrazine is sourced from PubChem (CID 151391312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).