(1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine

C6H13F3N2 — CID 105215778

IUPAC(1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine
SMILESCCC(C)C(NN)C(F)(F)F
InChIInChI=1S/C6H13F3N2/c1-3-4(2)5(11-10)6(7,8)9/h4-5,11H,3,10H2,1-2H3
InChIKeyOLESUVYRIQKJQX-UHFFFAOYSA-N
MW170.18 g/mol
LogP1.43
Rot. Bonds3

About (1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine

(1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine (PubChem CID 105215778) has the molecular formula C6H13F3N2 and a molecular weight of 170.18 g/mol. Its IUPAC name is (1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine.

Molecular Properties

Compound Name(1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine
PubChem CID105215778
Molecular FormulaC6H13F3N2
Molecular Weight170.18 g/mol
Exact Mass170.10
IUPAC Name(1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine
SMILESCCC(C)C(NN)C(F)(F)F
InChIInChI=1S/C6H13F3N2/c1-3-4(2)5(11-10)6(7,8)9/h4-5,11H,3,10H2,1-2H3
InChIKeyOLESUVYRIQKJQX-UHFFFAOYSA-N
XLogP1.43
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.18
LogP ≤ 51.43
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

N,N-diethyl-3-hydrazinyl-2,4-dimethylhexan-2-amine
CID 105239366
CID 174033921
CID 174033921
1,1,1-trifluoro-3,4-dimethylhexan-2-amine
CID 163739387
1,1,1-trifluoropropan-2-ylhydrazine
CID 20541215
(2R,3R)-3-methyl-N-(2,2,2-trifluoroethyl)pentan-2-amine
CID 28608773
3-[methyl-[(1,1,1-trifluoro-3-methylpentan-2-yl)carbamoyl]amino]propanoic acid
CID 122091656
methyl (2S)-3-methyl-2-[[(2S,3R)-1,1,1-trifluoro-3-(hydroxymethyl)-4-methylpentan-2-yl]amino]pentanoate
CID 139248291
methyl (2S,3S)-3-methyl-2-[[(2S,3S)-1,1,1-trifluoro-3-(hydroxymethyl)-4-methylpentan-2-yl]amino]pentanoate
CID 139248283
2,4,4-trimethylhexan-3-ylhydrazine
CID 105281793
3,3,5-trimethyloctan-4-ylhydrazine
CID 107896017
(2-methoxy-2-methylpentan-3-yl)hydrazine
CID 105245393
(1-methoxy-3-methylpentan-2-yl)hydrazine
CID 105207314

Frequently Asked Questions

What is the IUPAC name of (1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine?
The IUPAC name of (1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine (CID 105215778) is (1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine.
What is the SMILES notation for (1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine?
The canonical SMILES for (1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine is CCC(C)C(NN)C(F)(F)F.
What is the InChIKey of (1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine?
The InChIKey is OLESUVYRIQKJQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13F3N2/c1-3-4(2)5(11-10)6(7,8)9/h4-5,11H,3,10H2,1-2H3.
What are the key properties of (1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine?
(1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine has a molecular weight of 170.18 g/mol, XLogP of 1.43, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1,1,1-trifluoro-3-methylpentan-2-yl)hydrazine is sourced from PubChem (CID 105215778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).