4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide

C20H24N2O2 — CID 3421492

IUPAC4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCC(Cc3ccccc3)CC2)cc1
InChIInChI=1S/C20H24N2O2/c1-24-19-9-7-18(8-10-19)21-20(23)22-13-11-17(12-14-22)15-16-5-3-2-4-6-16/h2-10,17H,11-15H2,1H3,(H,21,23)
InChIKeyNZULPUROMPZMKZ-UHFFFAOYSA-N
MW324.42 g/mol
LogP4.18
Rot. Bonds4

About 4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide

4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide (PubChem CID 3421492) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide
PubChem CID3421492
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCC(Cc3ccccc3)CC2)cc1
InChIInChI=1S/C20H24N2O2/c1-24-19-9-7-18(8-10-19)21-20(23)22-13-11-17(12-14-22)15-16-5-3-2-4-6-16/h2-10,17H,11-15H2,1H3,(H,21,23)
InChIKeyNZULPUROMPZMKZ-UHFFFAOYSA-N
XLogP4.18
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide?
The IUPAC name of 4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide (CID 3421492) is 4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide?
The canonical SMILES for 4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide is COc1ccc(NC(=O)N2CCC(Cc3ccccc3)CC2)cc1.
What is the InChIKey of 4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide?
The InChIKey is NZULPUROMPZMKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-24-19-9-7-18(8-10-19)21-20(23)22-13-11-17(12-14-22)15-16-5-3-2-4-6-16/h2-10,17H,11-15H2,1H3,(H,21,23).
What are the key properties of 4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide?
4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide has a molecular weight of 324.42 g/mol, XLogP of 4.18, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-N-(4-methoxyphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 3421492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).