(1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine

C9H17F3N2 — CID 105205904

IUPAC(1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine
SMILESNNC(CC1CCCC1)CC(F)(F)F
InChIInChI=1S/C9H17F3N2/c10-9(11,12)6-8(14-13)5-7-3-1-2-4-7/h7-8,14H,1-6,13H2
InChIKeyAMTPYYUVIIIHDC-UHFFFAOYSA-N
MW210.24 g/mol
LogP2.35
Rot. Bonds4

About (1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine

(1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine (PubChem CID 105205904) has the molecular formula C9H17F3N2 and a molecular weight of 210.24 g/mol. Its IUPAC name is (1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine.

Molecular Properties

Compound Name(1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine
PubChem CID105205904
Molecular FormulaC9H17F3N2
Molecular Weight210.24 g/mol
Exact Mass210.13
IUPAC Name(1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine
SMILESNNC(CC1CCCC1)CC(F)(F)F
InChIInChI=1S/C9H17F3N2/c10-9(11,12)6-8(14-13)5-7-3-1-2-4-7/h7-8,14H,1-6,13H2
InChIKeyAMTPYYUVIIIHDC-UHFFFAOYSA-N
XLogP2.35
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 52.35
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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Frequently Asked Questions

What is the IUPAC name of (1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine?
The IUPAC name of (1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine (CID 105205904) is (1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine.
What is the SMILES notation for (1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine?
The canonical SMILES for (1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine is NNC(CC1CCCC1)CC(F)(F)F.
What is the InChIKey of (1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine?
The InChIKey is AMTPYYUVIIIHDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F3N2/c10-9(11,12)6-8(14-13)5-7-3-1-2-4-7/h7-8,14H,1-6,13H2.
What are the key properties of (1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine?
(1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine has a molecular weight of 210.24 g/mol, XLogP of 2.35, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclopentyl-4,4,4-trifluorobutan-2-yl)hydrazine is sourced from PubChem (CID 105205904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).