(3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide

C12H22N2O2 — CID 103338846

IUPAC(3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide
SMILESC=CCN(CCOC)C(=O)[C@@H]1CCCNC1
InChIInChI=1S/C12H22N2O2/c1-3-7-14(8-9-16-2)12(15)11-5-4-6-13-10-11/h3,11,13H,1,4-10H2,2H3/t11-/m1/s1
InChIKeySIAHXRUCVKUXNR-LLVKDONJSA-N
MW226.32 g/mol
LogP0.65
Rot. Bonds6

About (3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide

(3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide (PubChem CID 103338846) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is (3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide
PubChem CID103338846
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name(3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide
SMILESC=CCN(CCOC)C(=O)[C@@H]1CCCNC1
InChIInChI=1S/C12H22N2O2/c1-3-7-14(8-9-16-2)12(15)11-5-4-6-13-10-11/h3,11,13H,1,4-10H2,2H3/t11-/m1/s1
InChIKeySIAHXRUCVKUXNR-LLVKDONJSA-N
XLogP0.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3S)-N-ethyl-N-(2-methoxyethyl)piperidine-3-carboxamide
CID 81141076
(3R)-N-(2-hydroxyethyl)-N-(2-methoxyethyl)piperidine-3-carboxamide
CID 104861614
N-(2-methoxyethyl)-2-piperidin-3-yl-N-prop-2-enylacetamide
CID 103338928
2-[piperidine-3-carbonyl(prop-2-enyl)amino]acetic acid
CID 79265013
N-(2-methoxyethyl)-N-(3-phenylpropyl)piperidine-3-carboxamide
CID 119307596
N-[(4-methoxyphenyl)methyl]-N-prop-2-enylpiperidine-3-carboxamide;hydrochloride
CID 119299361
(3R)-N-butan-2-yl-N-(2-methoxyethyl)piperidine-3-carboxamide
CID 81140494
(3S)-N-butan-2-yl-N-(2-methoxyethyl)piperidine-3-carboxamide
CID 81140319
N-ethyl-N-prop-2-enylpyrrolidine-3-carboxamide
CID 81490031
(3R)-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)piperidine-3-carboxamide
CID 81129096
N,N-diethylpiperidine-3-carboxamide
CID 18793
(3S)-N-cyclopentyl-N-prop-2-enylpiperidine-3-carboxamide
CID 81128987

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide?
The IUPAC name of (3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide (CID 103338846) is (3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide is C=CCN(CCOC)C(=O)[C@@H]1CCCNC1.
What is the InChIKey of (3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide?
The InChIKey is SIAHXRUCVKUXNR-LLVKDONJSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-3-7-14(8-9-16-2)12(15)11-5-4-6-13-10-11/h3,11,13H,1,4-10H2,2H3/t11-/m1/s1.
What are the key properties of (3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide?
(3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 0.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(2-methoxyethyl)-N-prop-2-enylpiperidine-3-carboxamide is sourced from PubChem (CID 103338846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).