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

C7H14N2O2 — CID 15869910

IUPAC(2S)-2-amino-2-[(2R)-piperidin-2-yl]acetic acid
SMILESN[C@H](C(=O)O)[C@H]1CCCCN1
InChIInChI=1S/C7H14N2O2/c8-6(7(10)11)5-3-1-2-4-9-5/h5-6,9H,1-4,8H2,(H,10,11)/t5-,6+/m1/s1
InChIKeyORPZZYZKWRXDCT-RITPCOANSA-N
MW158.20 g/mol
LogP-0.46
Rot. Bonds2

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

(2S)-2-amino-2-[(2R)-piperidin-2-yl]acetic acid (PubChem CID 15869910) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is (2S)-2-amino-2-[(2R)-piperidin-2-yl]acetic acid.

Molecular Properties

Compound Name(2S)-2-amino-2-[(2R)-piperidin-2-yl]acetic acid
PubChem CID15869910
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name(2S)-2-amino-2-[(2R)-piperidin-2-yl]acetic acid
SMILESN[C@H](C(=O)O)[C@H]1CCCCN1
InChIInChI=1S/C7H14N2O2/c8-6(7(10)11)5-3-1-2-4-9-5/h5-6,9H,1-4,8H2,(H,10,11)/t5-,6+/m1/s1
InChIKeyORPZZYZKWRXDCT-RITPCOANSA-N
XLogP-0.46
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-2-[(2R)-piperidin-2-yl]acetic acid?
The IUPAC name of (2S)-2-amino-2-[(2R)-piperidin-2-yl]acetic acid (CID 15869910) is (2S)-2-amino-2-[(2R)-piperidin-2-yl]acetic acid.
What is the SMILES notation for (2S)-2-amino-2-[(2R)-piperidin-2-yl]acetic acid?
The canonical SMILES for (2S)-2-amino-2-[(2R)-piperidin-2-yl]acetic acid is N[C@H](C(=O)O)[C@H]1CCCCN1.
What is the InChIKey of (2S)-2-amino-2-[(2R)-piperidin-2-yl]acetic acid?
The InChIKey is ORPZZYZKWRXDCT-RITPCOANSA-N. The full InChI is InChI=1S/C7H14N2O2/c8-6(7(10)11)5-3-1-2-4-9-5/h5-6,9H,1-4,8H2,(H,10,11)/t5-,6+/m1/s1.
What are the key properties of (2S)-2-amino-2-[(2R)-piperidin-2-yl]acetic acid?
(2S)-2-amino-2-[(2R)-piperidin-2-yl]acetic acid has a molecular weight of 158.20 g/mol, XLogP of -0.46, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-2-[(2R)-piperidin-2-yl]acetic acid is sourced from PubChem (CID 15869910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).