methyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate

C11H20N2O3 — CID 93268446

IUPACmethyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate
SMILESCOC(=O)C(C)(C)NC(=O)[C@H]1CCCCN1
InChIInChI=1S/C11H20N2O3/c1-11(2,10(15)16-3)13-9(14)8-6-4-5-7-12-8/h8,12H,4-7H2,1-3H3,(H,13,14)/t8-/m1/s1
InChIKeyAHPKBDARXROGSS-MRVPVSSYSA-N
MW228.29 g/mol
LogP0.20
Rot. Bonds3

About methyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate

methyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate (PubChem CID 93268446) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is methyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate.

Molecular Properties

Compound Namemethyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate
PubChem CID93268446
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Namemethyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate
SMILESCOC(=O)C(C)(C)NC(=O)[C@H]1CCCCN1
InChIInChI=1S/C11H20N2O3/c1-11(2,10(15)16-3)13-9(14)8-6-4-5-7-12-8/h8,12H,4-7H2,1-3H3,(H,13,14)/t8-/m1/s1
InChIKeyAHPKBDARXROGSS-MRVPVSSYSA-N
XLogP0.20
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of methyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate?
The IUPAC name of methyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate (CID 93268446) is methyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate.
What is the SMILES notation for methyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate?
The canonical SMILES for methyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate is COC(=O)C(C)(C)NC(=O)[C@H]1CCCCN1.
What is the InChIKey of methyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate?
The InChIKey is AHPKBDARXROGSS-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-11(2,10(15)16-3)13-9(14)8-6-4-5-7-12-8/h8,12H,4-7H2,1-3H3,(H,13,14)/t8-/m1/s1.
What are the key properties of methyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate?
methyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate has a molecular weight of 228.29 g/mol, XLogP of 0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methyl-2-[[(2R)-piperidine-2-carbonyl]amino]propanoate is sourced from PubChem (CID 93268446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).