N-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine

C15H28N2O2 — CID 63642751

IUPACN-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine
SMILESCCN(C1CCC2(CC1)OCCO2)C1CCCNC1
InChIInChI=1S/C15H28N2O2/c1-2-17(14-4-3-9-16-12-14)13-5-7-15(8-6-13)18-10-11-19-15/h13-14,16H,2-12H2,1H3
InChIKeyCBKGVAQZEKFPFE-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.75
Rot. Bonds3

About N-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine

N-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine (PubChem CID 63642751) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine.

Molecular Properties

Compound NameN-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine
PubChem CID63642751
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine
SMILESCCN(C1CCC2(CC1)OCCO2)C1CCCNC1
InChIInChI=1S/C15H28N2O2/c1-2-17(14-4-3-9-16-12-14)13-5-7-15(8-6-13)18-10-11-19-15/h13-14,16H,2-12H2,1H3
InChIKeyCBKGVAQZEKFPFE-UHFFFAOYSA-N
XLogP1.75
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4,4-dimethylcycloheptyl)-N-ethylpyrrolidin-3-amine
CID 65086175
N-(1,4-dioxaspiro[4.5]decan-8-yl)-N-methylazepan-4-amine
CID 107171962
N-cyclohexyl-N-ethylpyrrolidin-3-amine;dihydrochloride
CID 56831616
N-cyclohexyl-N-ethylpyrrolidin-3-amine;hydrochloride
CID 156593457
N-ethyl-N-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-3-amine
CID 79927858
N-cyclohexyl-N-ethylazepan-4-amine
CID 63904813
N-ethyl-N-(3,3,5-trimethylcyclohexyl)piperidin-3-amine
CID 63644323
N-(3,3-dimethylcyclopentyl)-N-ethylpyrrolidin-3-amine
CID 80699221
N-ethyl-N-(2,4,4-trimethylcyclohexyl)piperidin-3-amine
CID 81320842
N-ethyl-N-(4-ethylcyclohexyl)pyrrolidin-3-amine
CID 63299411
N-ethyl-1-propan-2-yl-N-pyrrolidin-3-ylazepan-4-amine
CID 65077931
4-[ethyl(pyrrolidin-3-yl)amino]azepan-2-one
CID 63889082

Frequently Asked Questions

What is the IUPAC name of N-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine?
The IUPAC name of N-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine (CID 63642751) is N-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine.
What is the SMILES notation for N-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine?
The canonical SMILES for N-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine is CCN(C1CCC2(CC1)OCCO2)C1CCCNC1.
What is the InChIKey of N-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine?
The InChIKey is CBKGVAQZEKFPFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-2-17(14-4-3-9-16-12-14)13-5-7-15(8-6-13)18-10-11-19-15/h13-14,16H,2-12H2,1H3.
What are the key properties of N-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine?
N-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine has a molecular weight of 268.40 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,4-dioxaspiro[4.5]decan-8-yl)-N-ethylpiperidin-3-amine is sourced from PubChem (CID 63642751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).