[2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine

C15H30N2O2S — CID 105274344

IUPAC[2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine
SMILESCCC(C)(OC)C(NN)C1CCOC2(CCSCC2)C1
InChIInChI=1S/C15H30N2O2S/c1-4-14(2,18-3)13(17-16)12-5-8-19-15(11-12)6-9-20-10-7-15/h12-13,17H,4-11,16H2,1-3H3
InChIKeyOYAPGZAULDHWGD-UHFFFAOYSA-N
MW302.48 g/mol
LogP2.33
Rot. Bonds5

About [2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine

[2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine (PubChem CID 105274344) has the molecular formula C15H30N2O2S and a molecular weight of 302.48 g/mol. Its IUPAC name is [2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine.

Molecular Properties

Compound Name[2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine
PubChem CID105274344
Molecular FormulaC15H30N2O2S
Molecular Weight302.48 g/mol
Exact Mass302.20
IUPAC Name[2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine
SMILESCCC(C)(OC)C(NN)C1CCOC2(CCSCC2)C1
InChIInChI=1S/C15H30N2O2S/c1-4-14(2,18-3)13(17-16)12-5-8-19-15(11-12)6-9-20-10-7-15/h12-13,17H,4-11,16H2,1-3H3
InChIKeyOYAPGZAULDHWGD-UHFFFAOYSA-N
XLogP2.33
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.48
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

[2-ethoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)propyl]hydrazine
CID 105273997
2-methoxy-2-methyl-1-(6-oxa-2-thiaspiro[4.5]decan-9-yl)-N-propylbutan-1-amine
CID 116758127
2-methoxy-N,2-dimethyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)propan-1-amine
CID 79911973
2-methoxy-2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)-N-propylbutan-1-amine
CID 116758128
[2,2-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)butyl]hydrazine
CID 105322295
[2,2-dimethyl-1-(6-oxaspiro[4.5]decan-9-yl)butyl]hydrazine
CID 105325523
[1-(1,9-dioxaspiro[5.5]undecan-4-yl)-2,2-dimethylbutyl]hydrazine
CID 105323287
3-methoxy-3-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butan-1-ol
CID 103027641
[2-ethoxy-2-methyl-1-(6-oxaspiro[4.5]decan-9-yl)propyl]hydrazine
CID 105274222
[2-ethoxy-2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)propyl]hydrazine
CID 105274254
[2-ethoxy-2-ethyl-1-(5-oxaspiro[3.5]nonan-8-yl)butyl]hydrazine
CID 105275240
2-ethyl-2-methoxy-1-(6-oxa-2-thiaspiro[4.5]decan-9-yl)butan-1-amine
CID 116760457

Frequently Asked Questions

What is the IUPAC name of [2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine?
The IUPAC name of [2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine (CID 105274344) is [2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine.
What is the SMILES notation for [2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine?
The canonical SMILES for [2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine is CCC(C)(OC)C(NN)C1CCOC2(CCSCC2)C1.
What is the InChIKey of [2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine?
The InChIKey is OYAPGZAULDHWGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2S/c1-4-14(2,18-3)13(17-16)12-5-8-19-15(11-12)6-9-20-10-7-15/h12-13,17H,4-11,16H2,1-3H3.
What are the key properties of [2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine?
[2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine has a molecular weight of 302.48 g/mol, XLogP of 2.33, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methoxy-2-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)butyl]hydrazine is sourced from PubChem (CID 105274344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).