8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane

C17H34N2 — CID 64847996

IUPAC8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane
SMILESCCCCCN1CC(CC(C)C)NCC12CCCC2
InChIInChI=1S/C17H34N2/c1-4-5-8-11-19-13-16(12-15(2)3)18-14-17(19)9-6-7-10-17/h15-16,18H,4-14H2,1-3H3
InChIKeyCWLIJIFUFXDLLA-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.81
Rot. Bonds6

About 8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane

8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane (PubChem CID 64847996) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane
PubChem CID64847996
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane
SMILESCCCCCN1CC(CC(C)C)NCC12CCCC2
InChIInChI=1S/C17H34N2/c1-4-5-8-11-19-13-16(12-15(2)3)18-14-17(19)9-6-7-10-17/h15-16,18H,4-14H2,1-3H3
InChIKeyCWLIJIFUFXDLLA-UHFFFAOYSA-N
XLogP3.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.81
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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Related Compounds

1-hexyl-3-(2-methylpropyl)-1,4-diazaspiro[5.5]undecane
CID 64850121
1-butyl-3-(2-methylpropyl)-1,4-diazaspiro[5.5]undecane
CID 64848961
3-(2-methylpropyl)-1-propyl-1,4-diazaspiro[5.5]undecane
CID 64849927
3-ethyl-1-octyl-1,4-diazaspiro[5.5]undecane
CID 64843543
6-butyl-8-propyl-6,9-diazaspiro[4.5]decane
CID 64838046
3-butan-2-yl-1-hexyl-1,4-diazaspiro[5.5]undecane
CID 64848074
2-cyclopropyl-1-hexyl-2-methyl-5-(2-methylpropyl)piperazine
CID 64849739
6-butan-2-yl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane
CID 79445456
8-ethyl-6-(3-fluoropropyl)-6,9-diazaspiro[4.5]decane
CID 81114428
6-benzyl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane
CID 64848189
8-propan-2-yl-6-propyl-6,9-diazaspiro[4.5]decane
CID 64839855
3-(2-methylpropyl)-1-(oxolan-2-ylmethyl)-1,4-diazaspiro[5.5]undecane
CID 64849737

Frequently Asked Questions

What is the IUPAC name of 8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane?
The IUPAC name of 8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane (CID 64847996) is 8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane is CCCCCN1CC(CC(C)C)NCC12CCCC2.
What is the InChIKey of 8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane?
The InChIKey is CWLIJIFUFXDLLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-4-5-8-11-19-13-16(12-15(2)3)18-14-17(19)9-6-7-10-17/h15-16,18H,4-14H2,1-3H3.
What are the key properties of 8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane?
8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane has a molecular weight of 266.47 g/mol, XLogP of 3.81, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-methylpropyl)-6-pentyl-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 64847996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).