2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid

C12H22N2O2 — CID 10889611

IUPAC2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid
SMILESO=C(O)CN1CCC(N2CCCCC2)CC1
InChIInChI=1S/C12H22N2O2/c15-12(16)10-13-8-4-11(5-9-13)14-6-2-1-3-7-14/h11H,1-10H2,(H,15,16)
InChIKeyAEYVYPHDYRTLGS-UHFFFAOYSA-N
MW226.32 g/mol
LogP1.02
Rot. Bonds3

About 2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid

2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid (PubChem CID 10889611) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid.

Molecular Properties

Compound Name2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid
PubChem CID10889611
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid
SMILESO=C(O)CN1CCC(N2CCCCC2)CC1
InChIInChI=1S/C12H22N2O2/c15-12(16)10-13-8-4-11(5-9-13)14-6-2-1-3-7-14/h11H,1-10H2,(H,15,16)
InChIKeyAEYVYPHDYRTLGS-UHFFFAOYSA-N
XLogP1.02
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid?
The IUPAC name of 2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid (CID 10889611) is 2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid.
What is the SMILES notation for 2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid?
The canonical SMILES for 2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid is O=C(O)CN1CCC(N2CCCCC2)CC1.
What is the InChIKey of 2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid?
The InChIKey is AEYVYPHDYRTLGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c15-12(16)10-13-8-4-11(5-9-13)14-6-2-1-3-7-14/h11H,1-10H2,(H,15,16).
What are the key properties of 2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid?
2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid has a molecular weight of 226.32 g/mol, XLogP of 1.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-piperidin-1-ylpiperidin-1-yl)acetic acid is sourced from PubChem (CID 10889611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).