[1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine

C14H28F2N2O — CID 114225997

IUPAC[1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine
SMILESCCOC(CC)(CC)C(CC1CCC(F)(F)C1)NN
InChIInChI=1S/C14H28F2N2O/c1-4-13(5-2,19-6-3)12(18-17)9-11-7-8-14(15,16)10-11/h11-12,18H,4-10,17H2,1-3H3
InChIKeySQFKNTQXBUSCEF-UHFFFAOYSA-N
MW278.39 g/mol
LogP3.24
Rot. Bonds8

About [1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine

[1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine (PubChem CID 114225997) has the molecular formula C14H28F2N2O and a molecular weight of 278.39 g/mol. Its IUPAC name is [1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine
PubChem CID114225997
Molecular FormulaC14H28F2N2O
Molecular Weight278.39 g/mol
Exact Mass278.22
IUPAC Name[1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine
SMILESCCOC(CC)(CC)C(CC1CCC(F)(F)C1)NN
InChIInChI=1S/C14H28F2N2O/c1-4-13(5-2,19-6-3)12(18-17)9-11-7-8-14(15,16)10-11/h11-12,18H,4-10,17H2,1-3H3
InChIKeySQFKNTQXBUSCEF-UHFFFAOYSA-N
XLogP3.24
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.39
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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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
[7-Methyl-1-(2,2,2-trifluoroethoxy)octan-3-yl]hydrazine
CID 103151446
[1-Cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
CID 103151504
[5-Ethyl-1-(2,2,2-trifluoroethoxy)nonan-3-yl]hydrazine
CID 103151536
[1-(6-Oxaspiro[4.5]decan-9-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151562
[6-Methyl-1-(2,2,2-trifluoroethoxy)heptan-3-yl]hydrazine
CID 103151646
[5-Methyl-1-(2,2,2-trifluoroethoxy)octan-3-yl]hydrazine
CID 103151652
[1-Cyclopentyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151735
[1-(2,2-Difluoroethoxy)-7-methyloctan-3-yl]hydrazine
CID 103151765
[1-Cyclopentyl-4-(2,2-difluoroethoxy)butan-2-yl]hydrazine
CID 103151825
[1-(2,2-Difluoroethoxy)-5-ethylnonan-3-yl]hydrazine
CID 103151857

Frequently Asked Questions

What is the IUPAC name of [1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine?
The IUPAC name of [1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine (CID 114225997) is [1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine.
What is the SMILES notation for [1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine?
The canonical SMILES for [1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine is CCOC(CC)(CC)C(CC1CCC(F)(F)C1)NN.
What is the InChIKey of [1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine?
The InChIKey is SQFKNTQXBUSCEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28F2N2O/c1-4-13(5-2,19-6-3)12(18-17)9-11-7-8-14(15,16)10-11/h11-12,18H,4-10,17H2,1-3H3.
What are the key properties of [1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine?
[1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine has a molecular weight of 278.39 g/mol, XLogP of 3.24, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,3-difluorocyclopentyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine is sourced from PubChem (CID 114225997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).