2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid

C11H21NO2 — CID 142578712

IUPAC2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid
SMILESCCC(C)N1CCCC[C@@H]1CC(=O)O
InChIInChI=1S/C11H21NO2/c1-3-9(2)12-7-5-4-6-10(12)8-11(13)14/h9-10H,3-8H2,1-2H3,(H,13,14)/t9?,10-/m1/s1
InChIKeyFEYFYAJVTSWFDU-QVDQXJPCSA-N
MW199.29 g/mol
LogP2.11
Rot. Bonds4

About 2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid

2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid (PubChem CID 142578712) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid
PubChem CID142578712
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid
SMILESCCC(C)N1CCCC[C@@H]1CC(=O)O
InChIInChI=1S/C11H21NO2/c1-3-9(2)12-7-5-4-6-10(12)8-11(13)14/h9-10H,3-8H2,1-2H3,(H,13,14)/t9?,10-/m1/s1
InChIKeyFEYFYAJVTSWFDU-QVDQXJPCSA-N
XLogP2.11
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid?
The IUPAC name of 2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid (CID 142578712) is 2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid.
What is the SMILES notation for 2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid?
The canonical SMILES for 2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid is CCC(C)N1CCCC[C@@H]1CC(=O)O.
What is the InChIKey of 2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid?
The InChIKey is FEYFYAJVTSWFDU-QVDQXJPCSA-N. The full InChI is InChI=1S/C11H21NO2/c1-3-9(2)12-7-5-4-6-10(12)8-11(13)14/h9-10H,3-8H2,1-2H3,(H,13,14)/t9?,10-/m1/s1.
What are the key properties of 2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid?
2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid has a molecular weight of 199.29 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-1-butan-2-ylpiperidin-2-yl]acetic acid is sourced from PubChem (CID 142578712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).