1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane

C18H34N2 — CID 82937126

IUPAC1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane
SMILESCCC1(CC)CN(C2CCCC2)C2(CCCCC2)CN1
InChIInChI=1S/C18H34N2/c1-3-17(4-2)15-20(16-10-6-7-11-16)18(14-19-17)12-8-5-9-13-18/h16,19H,3-15H2,1-2H3
InChIKeyWYBOHGCQVJGFHD-UHFFFAOYSA-N
MW278.48 g/mol
LogP4.10
Rot. Bonds3

About 1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane

1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane (PubChem CID 82937126) has the molecular formula C18H34N2 and a molecular weight of 278.48 g/mol. Its IUPAC name is 1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane
PubChem CID82937126
Molecular FormulaC18H34N2
Molecular Weight278.48 g/mol
Exact Mass278.27
IUPAC Name1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane
SMILESCCC1(CC)CN(C2CCCC2)C2(CCCCC2)CN1
InChIInChI=1S/C18H34N2/c1-3-17(4-2)15-20(16-10-6-7-11-16)18(14-19-17)12-8-5-9-13-18/h16,19H,3-15H2,1-2H3
InChIKeyWYBOHGCQVJGFHD-UHFFFAOYSA-N
XLogP4.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.48
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8,8-diethyl-6-propan-2-yl-6,9-diazaspiro[4.5]decane
CID 64861426
3,3-diethyl-1-(2-methylpropyl)-1,4-diazaspiro[5.5]undecane
CID 64861044
9-cyclohexyl-8-ethyl-8-methyl-6,9-diazaspiro[4.5]decane
CID 82937208
4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane
CID 82937209
6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane
CID 79446556
6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane
CID 64861043
1-cycloheptyl-3,3-diethyl-7-methyl-1,4-diazepane
CID 82936957
4-cyclohexyl-3,3-dimethyl-1,4-diazaspiro[5.5]undecane
CID 82937035
1-cycloheptyl-5-cyclopropyl-2-ethyl-2,5-dimethylpiperazine
CID 82936095
1-cyclopentyl-2,5-diethyl-2,5-dimethylpiperazine
CID 82936178
1-cyclobutyl-5,5-diethyl-2-methylpiperazine
CID 64948334
1-cyclohexyl-3,3-diethyl-4,5-dihydro-2H-1,4-benzodiazepine
CID 82923899

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane?
The IUPAC name of 1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane (CID 82937126) is 1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane.
What is the SMILES notation for 1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane?
The canonical SMILES for 1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane is CCC1(CC)CN(C2CCCC2)C2(CCCCC2)CN1.
What is the InChIKey of 1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane?
The InChIKey is WYBOHGCQVJGFHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2/c1-3-17(4-2)15-20(16-10-6-7-11-16)18(14-19-17)12-8-5-9-13-18/h16,19H,3-15H2,1-2H3.
What are the key properties of 1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane?
1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane has a molecular weight of 278.48 g/mol, XLogP of 4.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane is sourced from PubChem (CID 82937126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).