[2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine

C15H28F2N2O — CID 114225999

IUPAC[2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine
SMILESCOC1(C(CC2CCC(F)(F)C2)NN)CCCC(C)C1
InChIInChI=1S/C15H28F2N2O/c1-11-4-3-6-14(9-11,20-2)13(19-18)8-12-5-7-15(16,17)10-12/h11-13,19H,3-10,18H2,1-2H3
InChIKeyJWTLFUDAOBCNLU-UHFFFAOYSA-N
MW290.40 g/mol
LogP3.24
Rot. Bonds5

About [2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine

[2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine (PubChem CID 114225999) has the molecular formula C15H28F2N2O and a molecular weight of 290.40 g/mol. Its IUPAC name is [2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine
PubChem CID114225999
Molecular FormulaC15H28F2N2O
Molecular Weight290.40 g/mol
Exact Mass290.22
IUPAC Name[2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine
SMILESCOC1(C(CC2CCC(F)(F)C2)NN)CCCC(C)C1
InChIInChI=1S/C15H28F2N2O/c1-11-4-3-6-14(9-11,20-2)13(19-18)8-12-5-7-15(16,17)10-12/h11-13,19H,3-10,18H2,1-2H3
InChIKeyJWTLFUDAOBCNLU-UHFFFAOYSA-N
XLogP3.24
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.40
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 [2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine?
The IUPAC name of [2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine (CID 114225999) is [2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine.
What is the SMILES notation for [2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine?
The canonical SMILES for [2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine is COC1(C(CC2CCC(F)(F)C2)NN)CCCC(C)C1.
What is the InChIKey of [2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine?
The InChIKey is JWTLFUDAOBCNLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28F2N2O/c1-11-4-3-6-14(9-11,20-2)13(19-18)8-12-5-7-15(16,17)10-12/h11-13,19H,3-10,18H2,1-2H3.
What are the key properties of [2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine?
[2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine has a molecular weight of 290.40 g/mol, XLogP of 3.24, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,3-difluorocyclopentyl)-1-(1-methoxy-3-methylcyclohexyl)ethyl]hydrazine is sourced from PubChem (CID 114225999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).