2-[(2S)-piperidin-2-yl]acetic acid

C7H13NO2 — CID 854351

IUPAC2-[(2S)-piperidin-2-yl]acetic acid
SMILESO=C(O)C[C@@H]1CCCCN1
InChIInChI=1S/C7H13NO2/c9-7(10)5-6-3-1-2-4-8-6/h6,8H,1-5H2,(H,9,10)/t6-/m0/s1
InChIKeyPRNLNZMJMCUWNV-LURJTMIESA-N
MW143.19 g/mol
LogP0.60
Rot. Bonds2

About 2-[(2S)-piperidin-2-yl]acetic acid

2-[(2S)-piperidin-2-yl]acetic acid (PubChem CID 854351) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is 2-[(2S)-piperidin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[(2S)-piperidin-2-yl]acetic acid
PubChem CID854351
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name2-[(2S)-piperidin-2-yl]acetic acid
SMILESO=C(O)C[C@@H]1CCCCN1
InChIInChI=1S/C7H13NO2/c9-7(10)5-6-3-1-2-4-8-6/h6,8H,1-5H2,(H,9,10)/t6-/m0/s1
InChIKeyPRNLNZMJMCUWNV-LURJTMIESA-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-(Piperidin-2-yl)acetic acid
CID 3164325
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
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-[(2S)-piperidin-2-yl]acetic acid?
The IUPAC name of 2-[(2S)-piperidin-2-yl]acetic acid (CID 854351) is 2-[(2S)-piperidin-2-yl]acetic acid.
What is the SMILES notation for 2-[(2S)-piperidin-2-yl]acetic acid?
The canonical SMILES for 2-[(2S)-piperidin-2-yl]acetic acid is O=C(O)C[C@@H]1CCCCN1.
What is the InChIKey of 2-[(2S)-piperidin-2-yl]acetic acid?
The InChIKey is PRNLNZMJMCUWNV-LURJTMIESA-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)/t6-/m0/s1.
What are the key properties of 2-[(2S)-piperidin-2-yl]acetic acid?
2-[(2S)-piperidin-2-yl]acetic 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-[(2S)-piperidin-2-yl]acetic acid is sourced from PubChem (CID 854351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).