propan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate

C13H26N2O2 — CID 143612384

IUPACpropan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate
SMILESCCC1CC(N)C[C@@H](CC)N1C(=O)OC(C)C
InChIInChI=1S/C13H26N2O2/c1-5-11-7-10(14)8-12(6-2)15(11)13(16)17-9(3)4/h9-12H,5-8,14H2,1-4H3/t10?,11-,12?/m1/s1
InChIKeyLZZHZXFMUCWLRL-MOENNCHZSA-N
MW242.36 g/mol
LogP2.51
Rot. Bonds3

About propan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate

propan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate (PubChem CID 143612384) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is propan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate.

Molecular Properties

Compound Namepropan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate
PubChem CID143612384
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Namepropan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate
SMILESCCC1CC(N)C[C@@H](CC)N1C(=O)OC(C)C
InChIInChI=1S/C13H26N2O2/c1-5-11-7-10(14)8-12(6-2)15(11)13(16)17-9(3)4/h9-12H,5-8,14H2,1-4H3/t10?,11-,12?/m1/s1
InChIKeyLZZHZXFMUCWLRL-MOENNCHZSA-N
XLogP2.51
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of propan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate?
The IUPAC name of propan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate (CID 143612384) is propan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate.
What is the SMILES notation for propan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate?
The canonical SMILES for propan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate is CCC1CC(N)C[C@@H](CC)N1C(=O)OC(C)C.
What is the InChIKey of propan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate?
The InChIKey is LZZHZXFMUCWLRL-MOENNCHZSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-5-11-7-10(14)8-12(6-2)15(11)13(16)17-9(3)4/h9-12H,5-8,14H2,1-4H3/t10?,11-,12?/m1/s1.
What are the key properties of propan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate?
propan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate has a molecular weight of 242.36 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl (2R)-4-amino-2,6-diethylpiperidine-1-carboxylate is sourced from PubChem (CID 143612384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).