[1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine

C13H28N2O — CID 103170450

IUPAC[1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine
SMILESCCOC1CC(CC(CCC(C)C)NN)C1
InChIInChI=1S/C13H28N2O/c1-4-16-13-8-11(9-13)7-12(15-14)6-5-10(2)3/h10-13,15H,4-9,14H2,1-3H3
InChIKeyAWRCIVQDHYAVCT-UHFFFAOYSA-N
MW228.38 g/mol
LogP2.46
Rot. Bonds8

About [1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine

[1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine (PubChem CID 103170450) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is [1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine
PubChem CID103170450
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name[1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine
SMILESCCOC1CC(CC(CCC(C)C)NN)C1
InChIInChI=1S/C13H28N2O/c1-4-16-13-8-11(9-13)7-12(15-14)6-5-10(2)3/h10-13,15H,4-9,14H2,1-3H3
InChIKeyAWRCIVQDHYAVCT-UHFFFAOYSA-N
XLogP2.46
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 52.46
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

[1-(3-Ethoxycyclobutyl)-5,5,5-trifluoropentan-2-yl]hydrazine
CID 103170593
[1-(3-Ethoxycyclobutyl)-6,6,6-trifluorohexan-2-yl]hydrazine
CID 103170729
(2-Propan-2-yloxan-4-yl)hydrazine
CID 64109526
[4-Methoxy-4-methyl-1-(oxan-4-yl)pentan-2-yl]hydrazine
CID 103025265
(1-Cyclobutyl-4-methoxy-4-methylpentan-2-yl)hydrazine
CID 103025331
[6-Methoxy-6-methyl-1-(oxolan-2-yl)heptan-4-yl]hydrazine
CID 103025357
(1-Cyclobutyl-3-methoxy-3-methylbutyl)hydrazine
CID 103025511
(2-Methoxy-2,7-dimethylnonan-5-yl)hydrazine
CID 103026314
(1-Cyclobutyl-4-methoxy-4-methylpentyl)hydrazine
CID 103026424
[5-Methoxy-5-methyl-1-(oxolan-3-yl)hexan-2-yl]hydrazine
CID 103027044
1-(3-Ethoxycyclobutyl)-3-methylbutan-2-amine
CID 103168201
1-(3-Ethoxycyclobutyl)butan-2-amine
CID 103168205

Frequently Asked Questions

What is the IUPAC name of [1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine?
The IUPAC name of [1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine (CID 103170450) is [1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine.
What is the SMILES notation for [1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine?
The canonical SMILES for [1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine is CCOC1CC(CC(CCC(C)C)NN)C1.
What is the InChIKey of [1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine?
The InChIKey is AWRCIVQDHYAVCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-4-16-13-8-11(9-13)7-12(15-14)6-5-10(2)3/h10-13,15H,4-9,14H2,1-3H3.
What are the key properties of [1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine?
[1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine has a molecular weight of 228.38 g/mol, XLogP of 2.46, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-ethoxycyclobutyl)-5-methylhexan-2-yl]hydrazine is sourced from PubChem (CID 103170450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).