[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine

C11H12F6N2 — CID 124633832

IUPAC[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine
SMILESCC[C@@H](NN)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
InChIInChI=1S/C11H12F6N2/c1-2-9(19-18)6-3-7(10(12,13)14)5-8(4-6)11(15,16)17/h3-5,9,19H,2,18H2,1H3/t9-/m1/s1
InChIKeyINDPVIFLKGYXEG-SECBINFHSA-N
MW286.22 g/mol
LogP3.64
Rot. Bonds3

About [(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine

[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine (PubChem CID 124633832) has the molecular formula C11H12F6N2 and a molecular weight of 286.22 g/mol. Its IUPAC name is [(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine.

Molecular Properties

Compound Name[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine
PubChem CID124633832
Molecular FormulaC11H12F6N2
Molecular Weight286.22 g/mol
Exact Mass286.09
IUPAC Name[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine
SMILESCC[C@@H](NN)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
InChIInChI=1S/C11H12F6N2/c1-2-9(19-18)6-3-7(10(12,13)14)5-8(4-6)11(15,16)17/h3-5,9,19H,2,18H2,1H3/t9-/m1/s1
InChIKeyINDPVIFLKGYXEG-SECBINFHSA-N
XLogP3.64
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.22
LogP ≤ 53.64
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-[3,5-bis(trifluoromethyl)phenyl]propan-1-amine
CID 18543623
1-(3,5-difluorophenyl)propylhydrazine
CID 53402270
(1R)-1-[3,5-bis(trifluoromethyl)phenyl]-2-methylbutan-1-amine;hydrochloride
CID 171198600
(1S)-1-[3,5-bis(trifluoromethyl)phenyl]-2-methylbutan-1-amine;hydrochloride
CID 171218118
1-(3-bromopentan-2-yl)-3,5-bis(trifluoromethyl)benzene
CID 79308013
1-[3-(trifluoromethyl)phenyl]nonylhydrazine
CID 105193857
[2-propoxy-1-[3-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105193830
N-methyl-1-[2,4,6-tris(trifluoromethyl)phenyl]propan-1-amine
CID 139965873
2-[3,5-bis(trifluoromethyl)phenyl]butanoic acid
CID 23225987
(1R)-1-[3-fluoro-5-(trifluoromethyl)phenyl]propan-1-ol
CID 97294480
2-[3,5-bis(trifluoromethyl)phenyl]butanoyl chloride
CID 23225989
1-[3,5-bis(trifluoromethyl)phenyl]-2-ethylsulfanylethanamine
CID 64615079

Frequently Asked Questions

What is the IUPAC name of [(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine?
The IUPAC name of [(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine (CID 124633832) is [(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine.
What is the SMILES notation for [(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine?
The canonical SMILES for [(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine is CC[C@@H](NN)c1cc(C(F)(F)F)cc(C(F)(F)F)c1.
What is the InChIKey of [(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine?
The InChIKey is INDPVIFLKGYXEG-SECBINFHSA-N. The full InChI is InChI=1S/C11H12F6N2/c1-2-9(19-18)6-3-7(10(12,13)14)5-8(4-6)11(15,16)17/h3-5,9,19H,2,18H2,1H3/t9-/m1/s1.
What are the key properties of [(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine?
[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine has a molecular weight of 286.22 g/mol, XLogP of 3.64, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-1-[3,5-bis(trifluoromethyl)phenyl]propyl]hydrazine is sourced from PubChem (CID 124633832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).