6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane

C14H26N2 — CID 64839988

IUPAC6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane
SMILESC=CCN1CC(CCC)NCC12CCCC2
InChIInChI=1S/C14H26N2/c1-3-7-13-11-16(10-4-2)14(12-15-13)8-5-6-9-14/h4,13,15H,2-3,5-12H2,1H3
InChIKeyLLKKUAPSGOLMPN-UHFFFAOYSA-N
MW222.38 g/mol
LogP2.56
Rot. Bonds4

About 6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane

6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane (PubChem CID 64839988) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is 6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane
PubChem CID64839988
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane
SMILESC=CCN1CC(CCC)NCC12CCCC2
InChIInChI=1S/C14H26N2/c1-3-7-13-11-16(10-4-2)14(12-15-13)8-5-6-9-14/h4,13,15H,2-3,5-12H2,1H3
InChIKeyLLKKUAPSGOLMPN-UHFFFAOYSA-N
XLogP2.56
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.56
H-Bond Donors ≤ 51
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 6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane?
The IUPAC name of 6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane (CID 64839988) is 6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane is C=CCN1CC(CCC)NCC12CCCC2.
What is the InChIKey of 6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane?
The InChIKey is LLKKUAPSGOLMPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-3-7-13-11-16(10-4-2)14(12-15-13)8-5-6-9-14/h4,13,15H,2-3,5-12H2,1H3.
What are the key properties of 6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane?
6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane has a molecular weight of 222.38 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-prop-2-enyl-8-propyl-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64839988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).