[cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine

C12H24N2OS — CID 105249607

IUPAC[cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine
SMILESNNC(C1CCCCCC1)C1CSCCO1
InChIInChI=1S/C12H24N2OS/c13-14-12(11-9-16-8-7-15-11)10-5-3-1-2-4-6-10/h10-12,14H,1-9,13H2
InChIKeyREUQFAAIXAWBJH-UHFFFAOYSA-N
MW244.40 g/mol
LogP1.92
Rot. Bonds3

About [cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine

[cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine (PubChem CID 105249607) has the molecular formula C12H24N2OS and a molecular weight of 244.40 g/mol. Its IUPAC name is [cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine
PubChem CID105249607
Molecular FormulaC12H24N2OS
Molecular Weight244.40 g/mol
Exact Mass244.16
IUPAC Name[cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine
SMILESNNC(C1CCCCCC1)C1CSCCO1
InChIInChI=1S/C12H24N2OS/c13-14-12(11-9-16-8-7-15-11)10-5-3-1-2-4-6-10/h10-12,14H,1-9,13H2
InChIKeyREUQFAAIXAWBJH-UHFFFAOYSA-N
XLogP1.92
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.40
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[cyclopentyl(1,4-oxathian-2-yl)methyl]hydrazine
CID 105249541
[2-cyclohexyl-1-(1,4-oxathian-2-yl)ethyl]hydrazine
CID 105249582
[cycloheptyl(oxan-2-yl)methyl]hydrazine
CID 105330645
[1,4-oxathian-2-yl(1-oxa-9-thiaspiro[5.5]undecan-4-yl)methyl]hydrazine
CID 105249551
1-(1,4-oxathian-2-yl)propylhydrazine
CID 105249656
[3-methyl-1-(1,4-oxathian-2-yl)butyl]hydrazine
CID 105249480
(1R)-1-(1,4-oxathian-2-yl)ethanamine
CID 104932096
[cyclohexyl-(3-methyloxolan-2-yl)methyl]hydrazine
CID 105282131
[1-(1,4-oxathian-2-yl)-2-phenylethyl]hydrazine
CID 105249482
[3-methylidene-1-(1,4-oxathian-2-yl)pentyl]hydrazine
CID 105249763
[(4-ethylcyclohexyl)-(oxan-2-yl)methyl]hydrazine
CID 105313042
1,4-oxathian-2-yl(oxolan-3-yl)methanol
CID 79963788

Frequently Asked Questions

What is the IUPAC name of [cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine?
The IUPAC name of [cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine (CID 105249607) is [cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine.
What is the SMILES notation for [cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine?
The canonical SMILES for [cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine is NNC(C1CCCCCC1)C1CSCCO1.
What is the InChIKey of [cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine?
The InChIKey is REUQFAAIXAWBJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2OS/c13-14-12(11-9-16-8-7-15-11)10-5-3-1-2-4-6-10/h10-12,14H,1-9,13H2.
What are the key properties of [cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine?
[cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine has a molecular weight of 244.40 g/mol, XLogP of 1.92, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [cycloheptyl(1,4-oxathian-2-yl)methyl]hydrazine is sourced from PubChem (CID 105249607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).