(2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one

C11H22N2O2 — CID 129393445

IUPAC(2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one
SMILESCCOC[C@@H]1CCCN(C(=O)[C@@H](C)N)C1
InChIInChI=1S/C11H22N2O2/c1-3-15-8-10-5-4-6-13(7-10)11(14)9(2)12/h9-10H,3-8,12H2,1-2H3/t9-,10-/m1/s1
InChIKeyUGIKTFJGQCNQEI-NXEZZACHSA-N
MW214.31 g/mol
LogP0.61
Rot. Bonds4

About (2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one

(2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one (PubChem CID 129393445) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is (2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one.

Molecular Properties

Compound Name(2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one
PubChem CID129393445
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name(2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one
SMILESCCOC[C@@H]1CCCN(C(=O)[C@@H](C)N)C1
InChIInChI=1S/C11H22N2O2/c1-3-15-8-10-5-4-6-13(7-10)11(14)9(2)12/h9-10H,3-8,12H2,1-2H3/t9-,10-/m1/s1
InChIKeyUGIKTFJGQCNQEI-NXEZZACHSA-N
XLogP0.61
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-1-[3-(ethoxymethyl)piperidin-1-yl]butan-1-one;hydrochloride
CID 119786526
2-amino-1-[3-(ethoxymethyl)piperidin-1-yl]-2-(oxan-4-yl)ethanone
CID 120793368
2-amino-1-[3-(hydroxymethyl)piperidin-1-yl]propan-1-one
CID 43590427
(2R)-2-amino-1-[(3R)-3-(fluoromethyl)piperidin-1-yl]propan-1-one
CID 129495721
N-butan-2-yl-3-(ethoxymethyl)piperidine-1-carboxamide
CID 110610311
(2S)-2-amino-1-[3-(ethoxymethyl)pyrrolidin-1-yl]butan-1-one;hydrochloride
CID 119341199
2-[1-(2-aminopropanoyl)piperidin-3-yl]acetamide;hydrochloride
CID 119339824
2-amino-1-[3-(methoxymethyl)piperidin-1-yl]-3-methylpentan-1-one
CID 103810688
N-[[(3R)-1-[(2S)-2-aminopropanoyl]piperidin-3-yl]methyl]acetamide
CID 96554564
ethyl 1-[(2R)-2-aminopropanoyl]piperidine-3-carboxylate;hydrochloride
CID 120872698
N-[[(3S)-1-[(2S)-2-aminopropanoyl]piperidin-3-yl]methyl]acetamide
CID 96554565
2-amino-1-[3-(methoxymethyl)piperidin-1-yl]pentan-1-one
CID 103796555

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one?
The IUPAC name of (2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one (CID 129393445) is (2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one.
What is the SMILES notation for (2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one?
The canonical SMILES for (2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one is CCOC[C@@H]1CCCN(C(=O)[C@@H](C)N)C1.
What is the InChIKey of (2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one?
The InChIKey is UGIKTFJGQCNQEI-NXEZZACHSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-3-15-8-10-5-4-6-13(7-10)11(14)9(2)12/h9-10H,3-8,12H2,1-2H3/t9-,10-/m1/s1.
What are the key properties of (2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one?
(2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one has a molecular weight of 214.31 g/mol, XLogP of 0.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-1-[(3R)-3-(ethoxymethyl)piperidin-1-yl]propan-1-one is sourced from PubChem (CID 129393445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).