(Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide

C11H20N2O2 — CID 143622632

IUPAC(Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide
SMILESCO/C=C(/C)C(=O)NCC1CCCNC1
InChIInChI=1S/C11H20N2O2/c1-9(8-15-2)11(14)13-7-10-4-3-5-12-6-10/h8,10,12H,3-7H2,1-2H3,(H,13,14)/b9-8-
InChIKeyXLMHXBHIJCJQMS-HJWRWDBZSA-N
MW212.29 g/mol
LogP0.65
Rot. Bonds4

About (Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide

(Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide (PubChem CID 143622632) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is (Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide.

Molecular Properties

Compound Name(Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide
PubChem CID143622632
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name(Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide
SMILESCO/C=C(/C)C(=O)NCC1CCCNC1
InChIInChI=1S/C11H20N2O2/c1-9(8-15-2)11(14)13-7-10-4-3-5-12-6-10/h8,10,12H,3-7H2,1-2H3,(H,13,14)/b9-8-
InChIKeyXLMHXBHIJCJQMS-HJWRWDBZSA-N
XLogP0.65
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(E)-2-methyl-N-[[(3R)-piperidin-3-yl]methyl]pent-2-enamide
CID 99978745
methyl 2-oxo-2-(piperidin-3-ylmethylamino)acetate
CID 117126374
methyl (Z)-3-(piperidin-3-ylmethylamino)but-2-enoate
CID 67572373
(Z)-3-(4-fluorophenyl)-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide;hydrochloride
CID 86779934
(Z)-2-methyl-N-[2-[(3R)-piperidin-3-yl]ethyl]pent-2-enamide
CID 96646542
1-(piperidin-3-ylmethyl)-3-propan-2-ylurea
CID 43208690
butyl N-(piperidin-3-ylmethyl)carbamate
CID 154053920
3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)propanamide;hydrochloride
CID 119461546
2-methoxy-N-(piperidin-3-ylmethyl)butanamide
CID 119461438
2,2,3,3-tetramethyl-N-(piperidin-3-ylmethyl)cyclopropane-1-carboxamide
CID 66475790
3,4-dimethylpent-2-en-2-yl N-(piperidin-3-ylmethyl)carbamate
CID 91043993
methyl 2-piperidin-3-ylacetate;dihydrochloride
CID 141033576

Frequently Asked Questions

What is the IUPAC name of (Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide?
The IUPAC name of (Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide (CID 143622632) is (Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide.
What is the SMILES notation for (Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide?
The canonical SMILES for (Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide is CO/C=C(/C)C(=O)NCC1CCCNC1.
What is the InChIKey of (Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide?
The InChIKey is XLMHXBHIJCJQMS-HJWRWDBZSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-9(8-15-2)11(14)13-7-10-4-3-5-12-6-10/h8,10,12H,3-7H2,1-2H3,(H,13,14)/b9-8-.
What are the key properties of (Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide?
(Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide has a molecular weight of 212.29 g/mol, XLogP of 0.65, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-methoxy-2-methyl-N-(piperidin-3-ylmethyl)prop-2-enamide is sourced from PubChem (CID 143622632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).