N-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide

C19H22N2O2 — CID 23607754

IUPACN-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCCC(c3ccccc3)C2)cc1
InChIInChI=1S/C19H22N2O2/c1-23-18-11-9-17(10-12-18)20-19(22)21-13-5-8-16(14-21)15-6-3-2-4-7-15/h2-4,6-7,9-12,16H,5,8,13-14H2,1H3,(H,20,22)
InChIKeyCPIBAPDUQWRZGF-UHFFFAOYSA-N
MW310.40 g/mol
LogP4.11
Rot. Bonds3

About N-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide

N-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide (PubChem CID 23607754) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide
PubChem CID23607754
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide
SMILESCOc1ccc(NC(=O)N2CCCC(c3ccccc3)C2)cc1
InChIInChI=1S/C19H22N2O2/c1-23-18-11-9-17(10-12-18)20-19(22)21-13-5-8-16(14-21)15-6-3-2-4-7-15/h2-4,6-7,9-12,16H,5,8,13-14H2,1H3,(H,20,22)
InChIKeyCPIBAPDUQWRZGF-UHFFFAOYSA-N
XLogP4.11
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide (CID 23607754) is N-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide is COc1ccc(NC(=O)N2CCCC(c3ccccc3)C2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide?
The InChIKey is CPIBAPDUQWRZGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-23-18-11-9-17(10-12-18)20-19(22)21-13-5-8-16(14-21)15-6-3-2-4-7-15/h2-4,6-7,9-12,16H,5,8,13-14H2,1H3,(H,20,22).
What are the key properties of N-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide?
N-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide has a molecular weight of 310.40 g/mol, XLogP of 4.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-3-phenylpiperidine-1-carboxamide is sourced from PubChem (CID 23607754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).