1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone

C14H25N3O3 — CID 39291577

IUPAC1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone
SMILESNC1CCN(C(=O)CN2CCC3(CC2)OCCO3)CC1
InChIInChI=1S/C14H25N3O3/c15-12-1-5-17(6-2-12)13(18)11-16-7-3-14(4-8-16)19-9-10-20-14/h12H,1-11,15H2
InChIKeyCUXXCPKJQUELDH-UHFFFAOYSA-N
MW283.37 g/mol
LogP-0.22
Rot. Bonds2

About 1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone

1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone (PubChem CID 39291577) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is 1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone.

Molecular Properties

Compound Name1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone
PubChem CID39291577
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC Name1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone
SMILESNC1CCN(C(=O)CN2CCC3(CC2)OCCO3)CC1
InChIInChI=1S/C14H25N3O3/c15-12-1-5-17(6-2-12)13(18)11-16-7-3-14(4-8-16)19-9-10-20-14/h12H,1-11,15H2
InChIKeyCUXXCPKJQUELDH-UHFFFAOYSA-N
XLogP-0.22
TPSA68.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 5-0.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone?
The IUPAC name of 1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone (CID 39291577) is 1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone.
What is the SMILES notation for 1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone?
The canonical SMILES for 1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone is NC1CCN(C(=O)CN2CCC3(CC2)OCCO3)CC1.
What is the InChIKey of 1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone?
The InChIKey is CUXXCPKJQUELDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O3/c15-12-1-5-17(6-2-12)13(18)11-16-7-3-14(4-8-16)19-9-10-20-14/h12H,1-11,15H2.
What are the key properties of 1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone?
1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone has a molecular weight of 283.37 g/mol, XLogP of -0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-aminopiperidin-1-yl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)ethanone is sourced from PubChem (CID 39291577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).