N-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine

C15H28N2O2 — CID 106622935

IUPACN-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine
SMILESCN(CC1CCCCN1)C1CCC2(CC1)OCCO2
InChIInChI=1S/C15H28N2O2/c1-17(12-13-4-2-3-9-16-13)14-5-7-15(8-6-14)18-10-11-19-15/h13-14,16H,2-12H2,1H3
InChIKeyDWQXKIRWRLFXLN-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.75
Rot. Bonds3

About N-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine

N-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine (PubChem CID 106622935) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine.

Molecular Properties

Compound NameN-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine
PubChem CID106622935
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine
SMILESCN(CC1CCCCN1)C1CCC2(CC1)OCCO2
InChIInChI=1S/C15H28N2O2/c1-17(12-13-4-2-3-9-16-13)14-5-7-15(8-6-14)18-10-11-19-15/h13-14,16H,2-12H2,1H3
InChIKeyDWQXKIRWRLFXLN-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-butyl-N-(pyrrolidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine
CID 106604774
2-ethyl-N,2-dimethyl-N-(piperidin-2-ylmethyl)oxan-4-amine
CID 106622844
N,3,3-trimethyl-N-(pyrrolidin-2-ylmethyl)cyclopentan-1-amine
CID 106602628
N,2,2-trimethyl-N-(pyrrolidin-2-ylmethyl)oxan-4-amine
CID 106602778
N-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]oxolan-3-amine
CID 104870205
N-methyl-N-(pyrrolidin-2-ylmethyl)oxolan-3-amine
CID 82739396
N-methyl-N-(piperidin-2-ylmethyl)thiolan-3-amine
CID 43296815
N-methyl-N-(piperidin-2-ylmethyl)-4-propylcycloheptan-1-amine
CID 106623130
N,N-dimethyl-1-piperidin-2-ylmethanamine;dihydrochloride
CID 45075192
4-tert-butyl-N-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106602645
1-[1,4-dioxaspiro[4.5]decan-8-yl(methyl)amino]propan-2-ol
CID 79119752
N-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-amine
CID 131134698

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine?
The IUPAC name of N-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine (CID 106622935) is N-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine.
What is the SMILES notation for N-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine?
The canonical SMILES for N-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine is CN(CC1CCCCN1)C1CCC2(CC1)OCCO2.
What is the InChIKey of N-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine?
The InChIKey is DWQXKIRWRLFXLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-17(12-13-4-2-3-9-16-13)14-5-7-15(8-6-14)18-10-11-19-15/h13-14,16H,2-12H2,1H3.
What are the key properties of N-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine?
N-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-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-methyl-N-(piperidin-2-ylmethyl)-1,4-dioxaspiro[4.5]decan-8-amine is sourced from PubChem (CID 106622935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).