1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine

C11H20N2O — CID 103560360

IUPAC1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine
SMILESCC#CCC(CC1(OC)CCC1)NN
InChIInChI=1S/C11H20N2O/c1-3-4-6-10(13-12)9-11(14-2)7-5-8-11/h10,13H,5-9,12H2,1-2H3
InChIKeyPWVBFROAKPARBE-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.19
Rot. Bonds5

About 1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine

1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine (PubChem CID 103560360) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine.

Molecular Properties

Compound Name1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine
PubChem CID103560360
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine
SMILESCC#CCC(CC1(OC)CCC1)NN
InChIInChI=1S/C11H20N2O/c1-3-4-6-10(13-12)9-11(14-2)7-5-8-11/h10,13H,5-9,12H2,1-2H3
InChIKeyPWVBFROAKPARBE-UHFFFAOYSA-N
XLogP1.19
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.19
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

(2-Methoxy-2-methyloct-6-yn-4-yl)hydrazine
CID 103025215
(2-Methoxy-2-methyloct-7-yn-4-yl)hydrazine
CID 103025321
(1-Cyclobutyl-4-methoxy-4-methylpentan-2-yl)hydrazine
CID 103025331
(2-Methoxy-2-methylnon-8-yn-4-yl)hydrazine
CID 103025470
(2-Methoxy-2-methylnon-7-yn-4-yl)hydrazine
CID 103025479
(1-Cyclobutyl-3-methoxy-3-methylbutyl)hydrazine
CID 103025511
[5,5,5-Trifluoro-1-(1-methoxycyclobutyl)pentan-2-yl]hydrazine
CID 103560484
(3-Methoxy-2,2,3-trimethylcyclobutyl)hydrazine
CID 129156321
(6-Methoxy-6-methylhept-1-yn-4-yl)hydrazine
CID 103025160
1-(1-Methoxycyclobutyl)pent-4-yn-2-amine
CID 103559002
1-(1-Methoxycyclobutyl)hex-4-yn-2-amine
CID 103559117
1-(1-Methoxycyclobutyl)pent-4-yn-2-ylhydrazine
CID 103560310

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine?
The IUPAC name of 1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine (CID 103560360) is 1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine.
What is the SMILES notation for 1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine?
The canonical SMILES for 1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine is CC#CCC(CC1(OC)CCC1)NN.
What is the InChIKey of 1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine?
The InChIKey is PWVBFROAKPARBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-3-4-6-10(13-12)9-11(14-2)7-5-8-11/h10,13H,5-9,12H2,1-2H3.
What are the key properties of 1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine?
1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine has a molecular weight of 196.29 g/mol, XLogP of 1.19, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxycyclobutyl)hex-4-yn-2-ylhydrazine is sourced from PubChem (CID 103560360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).