methyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate

C15H20N2O3 — CID 61147926

IUPACmethyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate
SMILESCOC(=O)C1CCN(C(=O)[C@H](N)c2ccccc2)CC1
InChIInChI=1S/C15H20N2O3/c1-20-15(19)12-7-9-17(10-8-12)14(18)13(16)11-5-3-2-4-6-11/h2-6,12-13H,7-10,16H2,1H3/t13-/m1/s1
InChIKeyAGMBZCOYTBEWJN-CYBMUJFWSA-N
MW276.34 g/mol
LogP1.10
Rot. Bonds3

About methyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate

methyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate (PubChem CID 61147926) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is methyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate.

Molecular Properties

Compound Namemethyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate
PubChem CID61147926
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Namemethyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate
SMILESCOC(=O)C1CCN(C(=O)[C@H](N)c2ccccc2)CC1
InChIInChI=1S/C15H20N2O3/c1-20-15(19)12-7-9-17(10-8-12)14(18)13(16)11-5-3-2-4-6-11/h2-6,12-13H,7-10,16H2,1H3/t13-/m1/s1
InChIKeyAGMBZCOYTBEWJN-CYBMUJFWSA-N
XLogP1.10
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze methyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate 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

methyl 1-(2-chloro-2-phenylacetyl)piperidine-4-carboxylate
CID 43245512
(2R)-2-amino-1-(4-methoxypiperidin-1-yl)-2-phenylethanone
CID 61156075
1-(2-amino-2-phenylacetyl)piperidine-4-carboxamide
CID 24695590
2-amino-1-[4-(4-methylpiperidine-1-carbonyl)piperidin-1-yl]-2-phenylethanone
CID 119297409
2-amino-1-[4-(methoxymethyl)piperidin-1-yl]-2-phenylethanone
CID 63979773
2-amino-2-phenyl-1-pyrrolidin-1-ylethanone
CID 24693981
(2R)-2-amino-1-(4-tert-butylpiperidin-1-yl)-2-phenylethanone
CID 62083998
(2S)-2-amino-1-(azocan-1-yl)-2-phenylethanone
CID 28801220
methyl 1-(2-phenoxypropanoyl)piperidine-4-carboxylate
CID 3927625
2-amino-2-phenyl-1-(4-phenylpiperidin-1-yl)ethanone
CID 119278410
2-amino-2-phenyl-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone;dihydrochloride
CID 119843387
methyl 1-(2-methoxy-2-phenylacetyl)pyrrolidine-3-carboxylate
CID 112733867

Frequently Asked Questions

What is the IUPAC name of methyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate?
The IUPAC name of methyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate (CID 61147926) is methyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate.
What is the SMILES notation for methyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate?
The canonical SMILES for methyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate is COC(=O)C1CCN(C(=O)[C@H](N)c2ccccc2)CC1.
What is the InChIKey of methyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate?
The InChIKey is AGMBZCOYTBEWJN-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-20-15(19)12-7-9-17(10-8-12)14(18)13(16)11-5-3-2-4-6-11/h2-6,12-13H,7-10,16H2,1H3/t13-/m1/s1.
What are the key properties of methyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate?
methyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate has a molecular weight of 276.34 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 1-[(2R)-2-amino-2-phenylacetyl]piperidine-4-carboxylate is sourced from PubChem (CID 61147926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).