2-[(2R)-1-ethylpiperidin-2-yl]acetic acid

C9H17NO2 — CID 93438443

IUPAC2-[(2R)-1-ethylpiperidin-2-yl]acetic acid
SMILESCCN1CCCC[C@@H]1CC(=O)O
InChIInChI=1S/C9H17NO2/c1-2-10-6-4-3-5-8(10)7-9(11)12/h8H,2-7H2,1H3,(H,11,12)/t8-/m1/s1
InChIKeyBICGGKMACBCFHQ-MRVPVSSYSA-N
MW171.24 g/mol
LogP1.34
Rot. Bonds3

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

2-[(2R)-1-ethylpiperidin-2-yl]acetic acid (PubChem CID 93438443) has the molecular formula C9H17NO2 and a molecular weight of 171.24 g/mol. Its IUPAC name is 2-[(2R)-1-ethylpiperidin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[(2R)-1-ethylpiperidin-2-yl]acetic acid
PubChem CID93438443
Molecular FormulaC9H17NO2
Molecular Weight171.24 g/mol
Exact Mass171.13
IUPAC Name2-[(2R)-1-ethylpiperidin-2-yl]acetic acid
SMILESCCN1CCCC[C@@H]1CC(=O)O
InChIInChI=1S/C9H17NO2/c1-2-10-6-4-3-5-8(10)7-9(11)12/h8H,2-7H2,1H3,(H,11,12)/t8-/m1/s1
InChIKeyBICGGKMACBCFHQ-MRVPVSSYSA-N
XLogP1.34
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.24
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[(2R)-1-ethylpiperidin-2-yl]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,6-dimethylpiperidine-2-carboxylic Acid
CID 4457948
(1-Methylpiperidin-2-yl)acetic acid
CID 3159683
1-Boc-2-Piperidineacetic Acid
CID 5058536
2-[(2S)-1-[(tert-butoxy)carbonyl]piperidin-2-yl]acetic acid
CID 1514276
2-((2R)-1-((tert-butoxy)carbonyl)piperidin-2-yl)acetic acid
CID 1514277
2-(1-Acetylpiperidin-2-yl)acetic acid
CID 14043894
2-(1-Methylpiperidin-2-yl)acetic acid hydrochloride
CID 45156844
1-Methyl-2-piperidinepropanoic acid
CID 45791119
6-Carboxyhexyl(triethyl)azanium chloride
CID 70695232
6-Carboxyhexyl-diethyl-methylazanium chloride
CID 70697256
(2R,6S)-1-methylpiperidine-2,6-dicarboxylic acid
CID 44312747
Octadecanoic acid, compd. with 1-dodecylpiperidine (1:1)
CID 163190

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-1-ethylpiperidin-2-yl]acetic acid?
The IUPAC name of 2-[(2R)-1-ethylpiperidin-2-yl]acetic acid (CID 93438443) is 2-[(2R)-1-ethylpiperidin-2-yl]acetic acid.
What is the SMILES notation for 2-[(2R)-1-ethylpiperidin-2-yl]acetic acid?
The canonical SMILES for 2-[(2R)-1-ethylpiperidin-2-yl]acetic acid is CCN1CCCC[C@@H]1CC(=O)O.
What is the InChIKey of 2-[(2R)-1-ethylpiperidin-2-yl]acetic acid?
The InChIKey is BICGGKMACBCFHQ-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H17NO2/c1-2-10-6-4-3-5-8(10)7-9(11)12/h8H,2-7H2,1H3,(H,11,12)/t8-/m1/s1.
What are the key properties of 2-[(2R)-1-ethylpiperidin-2-yl]acetic acid?
2-[(2R)-1-ethylpiperidin-2-yl]acetic acid has a molecular weight of 171.24 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-1-ethylpiperidin-2-yl]acetic acid is sourced from PubChem (CID 93438443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).