2-piperidin-2-ylacetic acid

C7H13NO2 — CID 3164325

IUPAC2-piperidin-2-ylacetic acid
SMILESO=C(O)CC1CCCCN1
InChIInChI=1S/C7H13NO2/c9-7(10)5-6-3-1-2-4-8-6/h6,8H,1-5H2,(H,9,10)
InChIKeyPRNLNZMJMCUWNV-UHFFFAOYSA-N
MW143.19 g/mol
LogP0.60
Rot. Bonds2

About 2-piperidin-2-ylacetic acid

2-piperidin-2-ylacetic acid (PubChem CID 3164325) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is 2-piperidin-2-ylacetic acid.

Molecular Properties

Compound Name2-piperidin-2-ylacetic acid
PubChem CID3164325
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name2-piperidin-2-ylacetic acid
SMILESO=C(O)CC1CCCCN1
InChIInChI=1S/C7H13NO2/c9-7(10)5-6-3-1-2-4-8-6/h6,8H,1-5H2,(H,9,10)
InChIKeyPRNLNZMJMCUWNV-UHFFFAOYSA-N
XLogP0.60
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-Piperidinedicarboxylic acid
CID 557515
(1-Methylpiperidin-2-yl)acetic acid
CID 3159683
NoName_3265
CID 3815667
(2R,6S)-piperidine-2,6-dicarboxylic acid
CID 10942932
2-(Piperidin-2-yl)acetic acid hydrochloride
CID 12514712
3-(Piperidin-2-yl)propanoic acid hydrochloride
CID 42614381
(S)-2-(Piperidin-2-yl)acetic acid
CID 854351
Methyl 2-(piperidin-2-yl)acetate hydrochloride
CID 13778732
2-(6-Oxopiperidin-2-yl)acetic acid
CID 14507691
2,2-Difluoro-2-(piperidin-2-yl)acetic acid hydrochloride
CID 86775561
2-((2S)-piperidin-2-yl)acetic acid hydrochloride
CID 118235722
Methyl piperidin-2-ylacetate
CID 5214606

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-2-ylacetic acid?
The IUPAC name of 2-piperidin-2-ylacetic acid (CID 3164325) is 2-piperidin-2-ylacetic acid.
What is the SMILES notation for 2-piperidin-2-ylacetic acid?
The canonical SMILES for 2-piperidin-2-ylacetic acid is O=C(O)CC1CCCCN1.
What is the InChIKey of 2-piperidin-2-ylacetic acid?
The InChIKey is PRNLNZMJMCUWNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c9-7(10)5-6-3-1-2-4-8-6/h6,8H,1-5H2,(H,9,10).
What are the key properties of 2-piperidin-2-ylacetic acid?
2-piperidin-2-ylacetic acid has a molecular weight of 143.19 g/mol, XLogP of 0.60, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-2-ylacetic acid is sourced from PubChem (CID 3164325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).