(2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide

C15H30N2O3 — CID 95161072

IUPAC(2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide
SMILESCCOCCO[C@H](C)C(=O)NC[C@@H]1CCCN(CC)C1
InChIInChI=1S/C15H30N2O3/c1-4-17-8-6-7-14(12-17)11-16-15(18)13(3)20-10-9-19-5-2/h13-14H,4-12H2,1-3H3,(H,16,18)/t13-,14+/m1/s1
InChIKeyPRKQURXEGQOXIC-KGLIPLIRSA-N
MW286.42 g/mol
LogP1.28
Rot. Bonds9

About (2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide

(2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide (PubChem CID 95161072) has the molecular formula C15H30N2O3 and a molecular weight of 286.42 g/mol. Its IUPAC name is (2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide.

Molecular Properties

Compound Name(2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide
PubChem CID95161072
Molecular FormulaC15H30N2O3
Molecular Weight286.42 g/mol
Exact Mass286.23
IUPAC Name(2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide
SMILESCCOCCO[C@H](C)C(=O)NC[C@@H]1CCCN(CC)C1
InChIInChI=1S/C15H30N2O3/c1-4-17-8-6-7-14(12-17)11-16-15(18)13(3)20-10-9-19-5-2/h13-14H,4-12H2,1-3H3,(H,16,18)/t13-,14+/m1/s1
InChIKeyPRKQURXEGQOXIC-KGLIPLIRSA-N
XLogP1.28
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(cycloheptylamino)ethyl]-2-(2-ethoxyethoxy)propanamide;hydrochloride
CID 119620567
(3S)-3-(2-ethoxyethyl)-1-ethylpiperidine
CID 173019176
2-cyclopentyl-N-[(1-ethylpiperidin-3-yl)methyl]acetamide
CID 75418465
(2S)-2-(2-ethoxyethoxy)-N-[3-[(2R)-2-methylpiperidin-1-yl]-3-oxopropyl]propanamide
CID 95295293
N-[[1-(3-ethoxypropyl)piperidin-3-yl]methyl]-2-methylpropan-1-amine
CID 65175422
N-[[(3S)-1-(2-methylpropyl)piperidin-3-yl]methyl]acetamide
CID 95187387
3-(ethylamino)-N-[(1-ethylpyrrolidin-3-yl)methyl]-2-methylpropanamide
CID 62851851
1-butan-2-yl-3-[(1-ethylpiperidin-3-yl)methyl]-2-methylguanidine;hydroiodide
CID 110943679
3-(ethoxymethyl)-1-ethylpiperidine
CID 91434061
bis(N-[(1-ethylpyrrolidin-3-yl)methyl]acetamide);methane
CID 162144356
(2S)-2-amino-N-[(1-ethylpyrrolidin-3-yl)methyl]hexanamide
CID 113304850
ethane;3-(ethoxymethyl)-1-ethylpiperidine
CID 144871592

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide?
The IUPAC name of (2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide (CID 95161072) is (2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide.
What is the SMILES notation for (2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide?
The canonical SMILES for (2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide is CCOCCO[C@H](C)C(=O)NC[C@@H]1CCCN(CC)C1.
What is the InChIKey of (2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide?
The InChIKey is PRKQURXEGQOXIC-KGLIPLIRSA-N. The full InChI is InChI=1S/C15H30N2O3/c1-4-17-8-6-7-14(12-17)11-16-15(18)13(3)20-10-9-19-5-2/h13-14H,4-12H2,1-3H3,(H,16,18)/t13-,14+/m1/s1.
What are the key properties of (2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide?
(2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide has a molecular weight of 286.42 g/mol, XLogP of 1.28, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-ethoxyethoxy)-N-[[(3S)-1-ethylpiperidin-3-yl]methyl]propanamide is sourced from PubChem (CID 95161072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).