(3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide

C12H23N3O3 — CID 94123913

IUPAC(3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide
SMILESCON(C)C(=O)[C@@H]1CCCN(C(=O)NC(C)C)C1
InChIInChI=1S/C12H23N3O3/c1-9(2)13-12(17)15-7-5-6-10(8-15)11(16)14(3)18-4/h9-10H,5-8H2,1-4H3,(H,13,17)/t10-/m1/s1
InChIKeyORNWZPBWHNYSPJ-SNVBAGLBSA-N
MW257.33 g/mol
LogP0.84
Rot. Bonds3

About (3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide

(3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide (PubChem CID 94123913) has the molecular formula C12H23N3O3 and a molecular weight of 257.33 g/mol. Its IUPAC name is (3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide.

Molecular Properties

Compound Name(3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide
PubChem CID94123913
Molecular FormulaC12H23N3O3
Molecular Weight257.33 g/mol
Exact Mass257.17
IUPAC Name(3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide
SMILESCON(C)C(=O)[C@@H]1CCCN(C(=O)NC(C)C)C1
InChIInChI=1S/C12H23N3O3/c1-9(2)13-12(17)15-7-5-6-10(8-15)11(16)14(3)18-4/h9-10H,5-8H2,1-4H3,(H,13,17)/t10-/m1/s1
InChIKeyORNWZPBWHNYSPJ-SNVBAGLBSA-N
XLogP0.84
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-N-methoxy-1-N,1-N,3-N-trimethylpiperidine-1,3-dicarboxamide
CID 60767416
tert-butyl 3-[methoxy(methyl)carbamoyl]piperidine-1-carboxylate;ethane
CID 142129006
(3S)-3-N-(1-cyanocyclobutyl)-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide
CID 95142294
methyl 3-[methyl(propan-2-yl)carbamoyl]piperidine-1-carboxylate
CID 86860285
(3R)-1-[[1-(dimethylamino)-1-oxopropan-2-yl]carbamoyl]piperidine-3-carboxylic acid
CID 81120309
(3S)-3-(methylamino)-N-propan-2-ylpiperidine-1-carboxamide
CID 94475900
N-methoxy-N-methylcyclobutanecarboxamide
CID 45084194
3-N-phenyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide
CID 42928143
3-hydroxy-2-[(3-methoxycarbonylpiperidine-1-carbonyl)amino]butanoic acid
CID 115535272
propan-2-yl 3-(dimethylcarbamoyl)piperidine-1-carboxylate
CID 177326825
1-(1-cyclopropylethylcarbamoyl)piperidine-3-carboxylic acid
CID 43533691
(3S)-3-N-(3,4-dichlorophenyl)-1-N-propan-2-ylpiperidine-1,3-dicarboxamide
CID 51941064

Frequently Asked Questions

What is the IUPAC name of (3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide?
The IUPAC name of (3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide (CID 94123913) is (3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide.
What is the SMILES notation for (3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide?
The canonical SMILES for (3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide is CON(C)C(=O)[C@@H]1CCCN(C(=O)NC(C)C)C1.
What is the InChIKey of (3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide?
The InChIKey is ORNWZPBWHNYSPJ-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H23N3O3/c1-9(2)13-12(17)15-7-5-6-10(8-15)11(16)14(3)18-4/h9-10H,5-8H2,1-4H3,(H,13,17)/t10-/m1/s1.
What are the key properties of (3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide?
(3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide has a molecular weight of 257.33 g/mol, XLogP of 0.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-N-methoxy-3-N-methyl-1-N-propan-2-ylpiperidine-1,3-dicarboxamide is sourced from PubChem (CID 94123913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).