9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane

C18H34N2 — CID 79879064

IUPAC9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane
SMILESCC(C)C1CNC2(CCCC2)CN1C1CCCC1(C)C
InChIInChI=1S/C18H34N2/c1-14(2)15-12-19-18(10-5-6-11-18)13-20(15)16-8-7-9-17(16,3)4/h14-16,19H,5-13H2,1-4H3
InChIKeyWIEOOCXETRISRK-UHFFFAOYSA-N
MW278.48 g/mol
LogP3.81
Rot. Bonds2

About 9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane

9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane (PubChem CID 79879064) has the molecular formula C18H34N2 and a molecular weight of 278.48 g/mol. Its IUPAC name is 9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane
PubChem CID79879064
Molecular FormulaC18H34N2
Molecular Weight278.48 g/mol
Exact Mass278.27
IUPAC Name9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane
SMILESCC(C)C1CNC2(CCCC2)CN1C1CCCC1(C)C
InChIInChI=1S/C18H34N2/c1-14(2)15-12-19-18(10-5-6-11-18)13-20(15)16-8-7-9-17(16,3)4/h14-16,19H,5-13H2,1-4H3
InChIKeyWIEOOCXETRISRK-UHFFFAOYSA-N
XLogP3.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.48
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane?
The IUPAC name of 9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane (CID 79879064) is 9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane is CC(C)C1CNC2(CCCC2)CN1C1CCCC1(C)C.
What is the InChIKey of 9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane?
The InChIKey is WIEOOCXETRISRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2/c1-14(2)15-12-19-18(10-5-6-11-18)13-20(15)16-8-7-9-17(16,3)4/h14-16,19H,5-13H2,1-4H3.
What are the key properties of 9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane?
9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane has a molecular weight of 278.48 g/mol, XLogP of 3.81, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 79879064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).