[1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine

C12H26N2O — CID 107896000

IUPAC[1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine
SMILESCCCC(C)C(CC1(OC)CCC1)NN
InChIInChI=1S/C12H26N2O/c1-4-6-10(2)11(14-13)9-12(15-3)7-5-8-12/h10-11,14H,4-9,13H2,1-3H3
InChIKeyRFSRLERYYLVQIE-UHFFFAOYSA-N
MW214.35 g/mol
LogP2.21
Rot. Bonds7

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

[1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine (PubChem CID 107896000) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine
PubChem CID107896000
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name[1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine
SMILESCCCC(C)C(CC1(OC)CCC1)NN
InChIInChI=1S/C12H26N2O/c1-4-6-10(2)11(14-13)9-12(15-3)7-5-8-12/h10-11,14H,4-9,13H2,1-3H3
InChIKeyRFSRLERYYLVQIE-UHFFFAOYSA-N
XLogP2.21
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 52.21
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-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine?
The IUPAC name of [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine (CID 107896000) is [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine.
What is the SMILES notation for [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine?
The canonical SMILES for [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine is CCCC(C)C(CC1(OC)CCC1)NN.
What is the InChIKey of [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine?
The InChIKey is RFSRLERYYLVQIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-6-10(2)11(14-13)9-12(15-3)7-5-8-12/h10-11,14H,4-9,13H2,1-3H3.
What are the key properties of [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine?
[1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine has a molecular weight of 214.35 g/mol, XLogP of 2.21, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-methoxycyclobutyl)-3-methylhexan-2-yl]hydrazine is sourced from PubChem (CID 107896000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).