2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid

C15H20N2O3 — CID 104913849

IUPAC2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid
SMILESCC(NC(=O)[C@H]1CCCCN1)(C(=O)O)c1ccccc1
InChIInChI=1S/C15H20N2O3/c1-15(14(19)20,11-7-3-2-4-8-11)17-13(18)12-9-5-6-10-16-12/h2-4,7-8,12,16H,5-6,9-10H2,1H3,(H,17,18)(H,19,20)/t12-,15?/m1/s1
InChIKeyHWZLXVVQHCSMND-KEKZHRQWSA-N
MW276.34 g/mol
LogP1.24
Rot. Bonds4

About 2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid

2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid (PubChem CID 104913849) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid.

Molecular Properties

Compound Name2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid
PubChem CID104913849
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid
SMILESCC(NC(=O)[C@H]1CCCCN1)(C(=O)O)c1ccccc1
InChIInChI=1S/C15H20N2O3/c1-15(14(19)20,11-7-3-2-4-8-11)17-13(18)12-9-5-6-10-16-12/h2-4,7-8,12,16H,5-6,9-10H2,1H3,(H,17,18)(H,19,20)/t12-,15?/m1/s1
InChIKeyHWZLXVVQHCSMND-KEKZHRQWSA-N
XLogP1.24
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic 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

2-phenyl-2-[[(2R)-pyrrolidine-2-carbonyl]amino]propanoic acid
CID 103870867
N-(1-hydroxy-2-phenylpropan-2-yl)piperidine-2-carboxamide
CID 105058124
2-(cycloheptanecarbonylamino)-2-phenylpropanoic acid
CID 62586316
(2S)-N-(2-methyl-2-phenylpropyl)piperidine-2-carboxamide
CID 93398876
(2R)-N-(2-methyl-2-phenylpropyl)piperidine-2-carboxamide;hydrochloride
CID 119724295
2-[(2-methylcyclopentanecarbonyl)amino]-2-phenylpropanoic acid
CID 107175398
(2S)-N-phenylpiperidine-2-carboxamide;hydrochloride
CID 68574355
2-[(2-cyclopentylacetyl)amino]-2-phenylpropanoic acid
CID 62487480
N-benzylpiperidine-2-carboxamide;hydrochloride
CID 53410820
(2R)-N'-phenylpiperidine-2-carbohydrazide
CID 124707340
N-[(1S)-1-phenylethyl]piperidine-2-carboxamide
CID 15445575
2-methyl-2-(piperidine-2-carbonylamino)pentanoic acid
CID 61159683

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid?
The IUPAC name of 2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid (CID 104913849) is 2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid.
What is the SMILES notation for 2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid?
The canonical SMILES for 2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid is CC(NC(=O)[C@H]1CCCCN1)(C(=O)O)c1ccccc1.
What is the InChIKey of 2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid?
The InChIKey is HWZLXVVQHCSMND-KEKZHRQWSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-15(14(19)20,11-7-3-2-4-8-11)17-13(18)12-9-5-6-10-16-12/h2-4,7-8,12,16H,5-6,9-10H2,1H3,(H,17,18)(H,19,20)/t12-,15?/m1/s1.
What are the key properties of 2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid?
2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid has a molecular weight of 276.34 g/mol, XLogP of 1.24, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoic acid is sourced from PubChem (CID 104913849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).