1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide

C14H19N3O2 — CID 33401914

IUPAC1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN([C@@H](C(N)=O)c2ccccc2)CC1
InChIInChI=1S/C14H19N3O2/c15-13(18)11-6-8-17(9-7-11)12(14(16)19)10-4-2-1-3-5-10/h1-5,11-12H,6-9H2,(H2,15,18)(H2,16,19)/t12-/m1/s1
InChIKeyBZLLJYAVORZQBE-GFCCVEGCSA-N
MW261.32 g/mol
LogP0.41
Rot. Bonds4

About 1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide

1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide (PubChem CID 33401914) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide
PubChem CID33401914
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN([C@@H](C(N)=O)c2ccccc2)CC1
InChIInChI=1S/C14H19N3O2/c15-13(18)11-6-8-17(9-7-11)12(14(16)19)10-4-2-1-3-5-10/h1-5,11-12H,6-9H2,(H2,15,18)(H2,16,19)/t12-/m1/s1
InChIKeyBZLLJYAVORZQBE-GFCCVEGCSA-N
XLogP0.41
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide?
The IUPAC name of 1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide (CID 33401914) is 1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide is NC(=O)C1CCN([C@@H](C(N)=O)c2ccccc2)CC1.
What is the InChIKey of 1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide?
The InChIKey is BZLLJYAVORZQBE-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H19N3O2/c15-13(18)11-6-8-17(9-7-11)12(14(16)19)10-4-2-1-3-5-10/h1-5,11-12H,6-9H2,(H2,15,18)(H2,16,19)/t12-/m1/s1.
What are the key properties of 1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide?
1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide has a molecular weight of 261.32 g/mol, XLogP of 0.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-2-amino-2-oxo-1-phenylethyl]piperidine-4-carboxamide is sourced from PubChem (CID 33401914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).