benzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate

C15H20N2O4 — CID 1484895

IUPACbenzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate
SMILESCONC(=O)C1CCN(C(=O)OCc2ccccc2)CC1
InChIInChI=1S/C15H20N2O4/c1-20-16-14(18)13-7-9-17(10-8-13)15(19)21-11-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3,(H,16,18)
InChIKeySVQFUFZLZPXMGV-UHFFFAOYSA-N
MW292.33 g/mol
LogP1.71
Rot. Bonds4

About benzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate

benzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate (PubChem CID 1484895) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is benzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate.

Molecular Properties

Compound Namebenzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate
PubChem CID1484895
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC Namebenzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate
SMILESCONC(=O)C1CCN(C(=O)OCc2ccccc2)CC1
InChIInChI=1S/C15H20N2O4/c1-20-16-14(18)13-7-9-17(10-8-13)15(19)21-11-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3,(H,16,18)
InChIKeySVQFUFZLZPXMGV-UHFFFAOYSA-N
XLogP1.71
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of benzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate?
The IUPAC name of benzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate (CID 1484895) is benzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate.
What is the SMILES notation for benzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate?
The canonical SMILES for benzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate is CONC(=O)C1CCN(C(=O)OCc2ccccc2)CC1.
What is the InChIKey of benzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate?
The InChIKey is SVQFUFZLZPXMGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-20-16-14(18)13-7-9-17(10-8-13)15(19)21-11-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3,(H,16,18).
What are the key properties of benzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate?
benzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate has a molecular weight of 292.33 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl 4-(methoxycarbamoyl)piperidine-1-carboxylate is sourced from PubChem (CID 1484895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).