2-(3-hydroxypiperidin-1-yl)acetic acid

C7H13NO3 — CID 46318283

IUPAC2-(3-hydroxypiperidin-1-yl)acetic acid
SMILESO=C(O)CN1CCCC(O)C1
InChIInChI=1S/C7H13NO3/c9-6-2-1-3-8(4-6)5-7(10)11/h6,9H,1-5H2,(H,10,11)
InChIKeyFVWNVXIYNYGOAS-UHFFFAOYSA-N
MW159.18 g/mol
LogP-0.47
Rot. Bonds2

About 2-(3-hydroxypiperidin-1-yl)acetic acid

2-(3-hydroxypiperidin-1-yl)acetic acid (PubChem CID 46318283) has the molecular formula C7H13NO3 and a molecular weight of 159.18 g/mol. Its IUPAC name is 2-(3-hydroxypiperidin-1-yl)acetic acid.

Molecular Properties

Compound Name2-(3-hydroxypiperidin-1-yl)acetic acid
PubChem CID46318283
Molecular FormulaC7H13NO3
Molecular Weight159.18 g/mol
Exact Mass159.09
IUPAC Name2-(3-hydroxypiperidin-1-yl)acetic acid
SMILESO=C(O)CN1CCCC(O)C1
InChIInChI=1S/C7H13NO3/c9-6-2-1-3-8(4-6)5-7(10)11/h6,9H,1-5H2,(H,10,11)
InChIKeyFVWNVXIYNYGOAS-UHFFFAOYSA-N
XLogP-0.47
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.18
LogP ≤ 5-0.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxypiperidin-1-yl)acetic acid?
The IUPAC name of 2-(3-hydroxypiperidin-1-yl)acetic acid (CID 46318283) is 2-(3-hydroxypiperidin-1-yl)acetic acid.
What is the SMILES notation for 2-(3-hydroxypiperidin-1-yl)acetic acid?
The canonical SMILES for 2-(3-hydroxypiperidin-1-yl)acetic acid is O=C(O)CN1CCCC(O)C1.
What is the InChIKey of 2-(3-hydroxypiperidin-1-yl)acetic acid?
The InChIKey is FVWNVXIYNYGOAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO3/c9-6-2-1-3-8(4-6)5-7(10)11/h6,9H,1-5H2,(H,10,11).
What are the key properties of 2-(3-hydroxypiperidin-1-yl)acetic acid?
2-(3-hydroxypiperidin-1-yl)acetic acid has a molecular weight of 159.18 g/mol, XLogP of -0.47, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxypiperidin-1-yl)acetic acid is sourced from PubChem (CID 46318283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).