acetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine

C13H25N3O3 — CID 154995595

IUPACacetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine
SMILESCC(=O)O.NNC1CCC(N2CC3(COC3)C2)CC1
InChIInChI=1S/C11H21N3O.C2H4O2/c12-13-9-1-3-10(4-2-9)14-5-11(6-14)7-15-8-11;1-2(3)4/h9-10,13H,1-8,12H2;1H3,(H,3,4)
InChIKeyUGOSOIUZHUWRMX-UHFFFAOYSA-N
MW271.36 g/mol
LogP0.18
Rot. Bonds2

About acetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine

acetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine (PubChem CID 154995595) has the molecular formula C13H25N3O3 and a molecular weight of 271.36 g/mol. Its IUPAC name is acetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine.

Molecular Properties

Compound Nameacetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine
PubChem CID154995595
Molecular FormulaC13H25N3O3
Molecular Weight271.36 g/mol
Exact Mass271.19
IUPAC Nameacetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine
SMILESCC(=O)O.NNC1CCC(N2CC3(COC3)C2)CC1
InChIInChI=1S/C11H21N3O.C2H4O2/c12-13-9-1-3-10(4-2-9)14-5-11(6-14)7-15-8-11;1-2(3)4/h9-10,13H,1-8,12H2;1H3,(H,3,4)
InChIKeyUGOSOIUZHUWRMX-UHFFFAOYSA-N
XLogP0.18
TPSA87.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 50.18
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of acetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine?
The IUPAC name of acetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine (CID 154995595) is acetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine.
What is the SMILES notation for acetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine?
The canonical SMILES for acetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine is CC(=O)O.NNC1CCC(N2CC3(COC3)C2)CC1.
What is the InChIKey of acetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine?
The InChIKey is UGOSOIUZHUWRMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O.C2H4O2/c12-13-9-1-3-10(4-2-9)14-5-11(6-14)7-15-8-11;1-2(3)4/h9-10,13H,1-8,12H2;1H3,(H,3,4).
What are the key properties of acetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine?
acetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine has a molecular weight of 271.36 g/mol, XLogP of 0.18, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;[4-(2-oxa-6-azaspiro[3.3]heptan-6-yl)cyclohexyl]hydrazine is sourced from PubChem (CID 154995595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).