N-(2-phenylmethoxyphenyl)piperidine-3-carboxamide

C19H22N2O2 — CID 54794739

IUPACN-(2-phenylmethoxyphenyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccccc1OCc1ccccc1)C1CCCNC1
InChIInChI=1S/C19H22N2O2/c22-19(16-9-6-12-20-13-16)21-17-10-4-5-11-18(17)23-14-15-7-2-1-3-8-15/h1-5,7-8,10-11,16,20H,6,9,12-14H2,(H,21,22)
InChIKeyCXLCVIXJGURFDU-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.20
Rot. Bonds5

About N-(2-phenylmethoxyphenyl)piperidine-3-carboxamide

N-(2-phenylmethoxyphenyl)piperidine-3-carboxamide (PubChem CID 54794739) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-(2-phenylmethoxyphenyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-phenylmethoxyphenyl)piperidine-3-carboxamide
PubChem CID54794739
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-(2-phenylmethoxyphenyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccccc1OCc1ccccc1)C1CCCNC1
InChIInChI=1S/C19H22N2O2/c22-19(16-9-6-12-20-13-16)21-17-10-4-5-11-18(17)23-14-15-7-2-1-3-8-15/h1-5,7-8,10-11,16,20H,6,9,12-14H2,(H,21,22)
InChIKeyCXLCVIXJGURFDU-UHFFFAOYSA-N
XLogP3.20
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenylmethoxyphenyl)piperidine-3-carboxamide?
The IUPAC name of N-(2-phenylmethoxyphenyl)piperidine-3-carboxamide (CID 54794739) is N-(2-phenylmethoxyphenyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(2-phenylmethoxyphenyl)piperidine-3-carboxamide?
The canonical SMILES for N-(2-phenylmethoxyphenyl)piperidine-3-carboxamide is O=C(Nc1ccccc1OCc1ccccc1)C1CCCNC1.
What is the InChIKey of N-(2-phenylmethoxyphenyl)piperidine-3-carboxamide?
The InChIKey is CXLCVIXJGURFDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c22-19(16-9-6-12-20-13-16)21-17-10-4-5-11-18(17)23-14-15-7-2-1-3-8-15/h1-5,7-8,10-11,16,20H,6,9,12-14H2,(H,21,22).
What are the key properties of N-(2-phenylmethoxyphenyl)piperidine-3-carboxamide?
N-(2-phenylmethoxyphenyl)piperidine-3-carboxamide has a molecular weight of 310.40 g/mol, XLogP of 3.20, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylmethoxyphenyl)piperidine-3-carboxamide is sourced from PubChem (CID 54794739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).