[1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine

C14H28F2N2O — CID 114225996

IUPAC[1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine
SMILESCOC(C(CC1CCCC(F)(F)C1)NN)C(C)(C)C
InChIInChI=1S/C14H28F2N2O/c1-13(2,3)12(19-4)11(18-17)8-10-6-5-7-14(15,16)9-10/h10-12,18H,5-9,17H2,1-4H3
InChIKeyHKAKTHKVUWGWGW-UHFFFAOYSA-N
MW278.39 g/mol
LogP3.10
Rot. Bonds5

About [1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine

[1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine (PubChem CID 114225996) has the molecular formula C14H28F2N2O and a molecular weight of 278.39 g/mol. Its IUPAC name is [1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine
PubChem CID114225996
Molecular FormulaC14H28F2N2O
Molecular Weight278.39 g/mol
Exact Mass278.22
IUPAC Name[1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine
SMILESCOC(C(CC1CCCC(F)(F)C1)NN)C(C)(C)C
InChIInChI=1S/C14H28F2N2O/c1-13(2,3)12(19-4)11(18-17)8-10-6-5-7-14(15,16)9-10/h10-12,18H,5-9,17H2,1-4H3
InChIKeyHKAKTHKVUWGWGW-UHFFFAOYSA-N
XLogP3.10
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.39
LogP ≤ 53.10
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 [1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine?
The IUPAC name of [1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine (CID 114225996) is [1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine.
What is the SMILES notation for [1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine?
The canonical SMILES for [1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine is COC(C(CC1CCCC(F)(F)C1)NN)C(C)(C)C.
What is the InChIKey of [1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine?
The InChIKey is HKAKTHKVUWGWGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28F2N2O/c1-13(2,3)12(19-4)11(18-17)8-10-6-5-7-14(15,16)9-10/h10-12,18H,5-9,17H2,1-4H3.
What are the key properties of [1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine?
[1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine has a molecular weight of 278.39 g/mol, XLogP of 3.10, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,3-difluorocyclohexyl)-3-methoxy-4,4-dimethylpentan-2-yl]hydrazine is sourced from PubChem (CID 114225996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).