[1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine

C13H26F2N2O — CID 103026280

IUPAC[1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine
SMILESCOC(C)(C)CCC(NN)C1CCC(F)(F)CC1
InChIInChI=1S/C13H26F2N2O/c1-12(2,18-3)7-6-11(17-16)10-4-8-13(14,15)9-5-10/h10-11,17H,4-9,16H2,1-3H3
InChIKeyAONBZEJBEAWBGQ-UHFFFAOYSA-N
MW264.36 g/mol
LogP2.85
Rot. Bonds6

About [1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine

[1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine (PubChem CID 103026280) has the molecular formula C13H26F2N2O and a molecular weight of 264.36 g/mol. Its IUPAC name is [1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine.

Molecular Properties

Compound Name[1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine
PubChem CID103026280
Molecular FormulaC13H26F2N2O
Molecular Weight264.36 g/mol
Exact Mass264.20
IUPAC Name[1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine
SMILESCOC(C)(C)CCC(NN)C1CCC(F)(F)CC1
InChIInChI=1S/C13H26F2N2O/c1-12(2,18-3)7-6-11(17-16)10-4-8-13(14,15)9-5-10/h10-11,17H,4-9,16H2,1-3H3
InChIKeyAONBZEJBEAWBGQ-UHFFFAOYSA-N
XLogP2.85
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.36
LogP ≤ 52.85
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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Related Compounds

(8,8,8-Trifluoro-2-methoxy-2-methyloctan-4-yl)hydrazine
CID 103025443
(1,1,1-Trifluoro-7-methoxy-7-methyloctan-4-yl)hydrazine
CID 103026297
[4-Methoxy-4-methyl-1-[3-(trifluoromethyl)cyclohexyl]pentyl]hydrazine
CID 103026334
[4-Methoxy-4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pentyl]hydrazine
CID 103026395
(1,1,1-Trifluoro-6-methoxy-6-methylheptan-3-yl)hydrazine
CID 103026460
[4-Methoxy-4-methyl-1-[4-(trifluoromethyl)cyclohexyl]pentyl]hydrazine
CID 103026483
4-Methoxy-4-methyl-1-[4-(trifluoromethyl)cyclohexyl]pentan-1-amine
CID 103031844
4-Methoxy-4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pentan-1-amine
CID 103031870
4-Methoxy-4-methyl-1-[3-(trifluoromethyl)cyclohexyl]pentan-1-amine
CID 103031991
1-(4,4-Difluorocyclohexyl)-4-methoxy-4-methylpentan-1-amine
CID 103032005
[1-(5-Oxaspiro[3.5]nonan-8-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151509
[5-Ethyl-1-(2,2,2-trifluoroethoxy)nonan-3-yl]hydrazine
CID 103151536

Frequently Asked Questions

What is the IUPAC name of [1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine?
The IUPAC name of [1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine (CID 103026280) is [1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine.
What is the SMILES notation for [1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine?
The canonical SMILES for [1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine is COC(C)(C)CCC(NN)C1CCC(F)(F)CC1.
What is the InChIKey of [1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine?
The InChIKey is AONBZEJBEAWBGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26F2N2O/c1-12(2,18-3)7-6-11(17-16)10-4-8-13(14,15)9-5-10/h10-11,17H,4-9,16H2,1-3H3.
What are the key properties of [1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine?
[1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine has a molecular weight of 264.36 g/mol, XLogP of 2.85, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4,4-difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine is sourced from PubChem (CID 103026280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).