[6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine

C10H17F3N4 — CID 103025573

IUPAC[6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine
SMILESCn1cc(CCC(CCC(F)(F)F)NN)cn1
InChIInChI=1S/C10H17F3N4/c1-17-7-8(6-15-17)2-3-9(16-14)4-5-10(11,12)13/h6-7,9,16H,2-5,14H2,1H3
InChIKeyFRLSQGYEKWCVPV-UHFFFAOYSA-N
MW250.27 g/mol
LogP1.53
Rot. Bonds6

About [6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine

[6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine (PubChem CID 103025573) has the molecular formula C10H17F3N4 and a molecular weight of 250.27 g/mol. Its IUPAC name is [6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine.

Molecular Properties

Compound Name[6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine
PubChem CID103025573
Molecular FormulaC10H17F3N4
Molecular Weight250.27 g/mol
Exact Mass250.14
IUPAC Name[6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine
SMILESCn1cc(CCC(CCC(F)(F)F)NN)cn1
InChIInChI=1S/C10H17F3N4/c1-17-7-8(6-15-17)2-3-9(16-14)4-5-10(11,12)13/h6-7,9,16H,2-5,14H2,1H3
InChIKeyFRLSQGYEKWCVPV-UHFFFAOYSA-N
XLogP1.53
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.27
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

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CID 63085164
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cyclobutyl(1-methyl-1H-pyrazol-4-yl)methanamine
CID 43124235
4-(1-methyl-1H-pyrazol-4-yl)butan-1-amine
CID 50988989
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CID 62127805
1-Methyl-4-octylpyrazole
CID 44222592
1-(1-ethyl-1H-pyrazol-4-yl)propan-1-amine
CID 23005819
4-[3,3-Difluoro-3-(1-methylpyrazol-4-yl)propyl]piperidine
CID 18187752
1-(2-Fluoroethyl)-4-pentylpyrazole
CID 69998690
1-(2,2-Difluoroethyl)-4-octan-2-ylpyrazole
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CID 134556292

Frequently Asked Questions

What is the IUPAC name of [6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine?
The IUPAC name of [6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine (CID 103025573) is [6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine.
What is the SMILES notation for [6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine?
The canonical SMILES for [6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine is Cn1cc(CCC(CCC(F)(F)F)NN)cn1.
What is the InChIKey of [6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine?
The InChIKey is FRLSQGYEKWCVPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N4/c1-17-7-8(6-15-17)2-3-9(16-14)4-5-10(11,12)13/h6-7,9,16H,2-5,14H2,1H3.
What are the key properties of [6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine?
[6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine has a molecular weight of 250.27 g/mol, XLogP of 1.53, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6,6,6-trifluoro-1-(1-methylpyrazol-4-yl)hexan-3-yl]hydrazine is sourced from PubChem (CID 103025573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).