2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane

C14H26N2 — CID 166846844

IUPAC2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane
SMILESC=CCN1CCC2(CC1)CCN(C(C)C)C2
InChIInChI=1S/C14H26N2/c1-4-8-15-9-5-14(6-10-15)7-11-16(12-14)13(2)3/h4,13H,1,5-12H2,2-3H3
InChIKeyAZWFMHGJRJZDEU-UHFFFAOYSA-N
MW222.38 g/mol
LogP2.37
Rot. Bonds3

About 2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane

2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane (PubChem CID 166846844) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is 2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane
PubChem CID166846844
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane
SMILESC=CCN1CCC2(CC1)CCN(C(C)C)C2
InChIInChI=1S/C14H26N2/c1-4-8-15-9-5-14(6-10-15)7-11-16(12-14)13(2)3/h4,13H,1,5-12H2,2-3H3
InChIKeyAZWFMHGJRJZDEU-UHFFFAOYSA-N
XLogP2.37
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane?
The IUPAC name of 2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane (CID 166846844) is 2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane is C=CCN1CCC2(CC1)CCN(C(C)C)C2.
What is the InChIKey of 2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane?
The InChIKey is AZWFMHGJRJZDEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-4-8-15-9-5-14(6-10-15)7-11-16(12-14)13(2)3/h4,13H,1,5-12H2,2-3H3.
What are the key properties of 2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane?
2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane has a molecular weight of 222.38 g/mol, XLogP of 2.37, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-8-prop-2-enyl-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 166846844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).