11-nonyl-7,11-diazaspiro[5.6]dodecane

C19H38N2 — CID 64857646

IUPAC11-nonyl-7,11-diazaspiro[5.6]dodecane
SMILESCCCCCCCCCN1CCCNC2(CCCCC2)C1
InChIInChI=1S/C19H38N2/c1-2-3-4-5-6-7-11-16-21-17-12-15-20-19(18-21)13-9-8-10-14-19/h20H,2-18H2,1H3
InChIKeyLYUXGIQHOKPKRY-UHFFFAOYSA-N
MW294.53 g/mol
LogP4.74
Rot. Bonds8

About 11-nonyl-7,11-diazaspiro[5.6]dodecane

11-nonyl-7,11-diazaspiro[5.6]dodecane (PubChem CID 64857646) has the molecular formula C19H38N2 and a molecular weight of 294.53 g/mol. Its IUPAC name is 11-nonyl-7,11-diazaspiro[5.6]dodecane.

Molecular Properties

Compound Name11-nonyl-7,11-diazaspiro[5.6]dodecane
PubChem CID64857646
Molecular FormulaC19H38N2
Molecular Weight294.53 g/mol
Exact Mass294.30
IUPAC Name11-nonyl-7,11-diazaspiro[5.6]dodecane
SMILESCCCCCCCCCN1CCCNC2(CCCCC2)C1
InChIInChI=1S/C19H38N2/c1-2-3-4-5-6-7-11-16-21-17-12-15-20-19(18-21)13-9-8-10-14-19/h20H,2-18H2,1H3
InChIKeyLYUXGIQHOKPKRY-UHFFFAOYSA-N
XLogP4.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.53
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 11-nonyl-7,11-diazaspiro[5.6]dodecane?
The IUPAC name of 11-nonyl-7,11-diazaspiro[5.6]dodecane (CID 64857646) is 11-nonyl-7,11-diazaspiro[5.6]dodecane.
What is the SMILES notation for 11-nonyl-7,11-diazaspiro[5.6]dodecane?
The canonical SMILES for 11-nonyl-7,11-diazaspiro[5.6]dodecane is CCCCCCCCCN1CCCNC2(CCCCC2)C1.
What is the InChIKey of 11-nonyl-7,11-diazaspiro[5.6]dodecane?
The InChIKey is LYUXGIQHOKPKRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38N2/c1-2-3-4-5-6-7-11-16-21-17-12-15-20-19(18-21)13-9-8-10-14-19/h20H,2-18H2,1H3.
What are the key properties of 11-nonyl-7,11-diazaspiro[5.6]dodecane?
11-nonyl-7,11-diazaspiro[5.6]dodecane has a molecular weight of 294.53 g/mol, XLogP of 4.74, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-nonyl-7,11-diazaspiro[5.6]dodecane is sourced from PubChem (CID 64857646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).