3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide

C22H28N2O2 — CID 56853055

IUPAC3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide
SMILESO=C(CCOc1ccccc1)NC1CCCN(CCc2ccccc2)C1
InChIInChI=1S/C22H28N2O2/c25-22(14-17-26-21-11-5-2-6-12-21)23-20-10-7-15-24(18-20)16-13-19-8-3-1-4-9-19/h1-6,8-9,11-12,20H,7,10,13-18H2,(H,23,25)
InChIKeyYRENOPYDPVIGQD-UHFFFAOYSA-N
MW352.48 g/mol
LogP3.28
Rot. Bonds8

About 3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide

3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide (PubChem CID 56853055) has the molecular formula C22H28N2O2 and a molecular weight of 352.48 g/mol. Its IUPAC name is 3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide.

Molecular Properties

Compound Name3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide
PubChem CID56853055
Molecular FormulaC22H28N2O2
Molecular Weight352.48 g/mol
Exact Mass352.22
IUPAC Name3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide
SMILESO=C(CCOc1ccccc1)NC1CCCN(CCc2ccccc2)C1
InChIInChI=1S/C22H28N2O2/c25-22(14-17-26-21-11-5-2-6-12-21)23-20-10-7-15-24(18-20)16-13-19-8-3-1-4-9-19/h1-6,8-9,11-12,20H,7,10,13-18H2,(H,23,25)
InChIKeyYRENOPYDPVIGQD-UHFFFAOYSA-N
XLogP3.28
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-phenylethyl)piperidin-3-yl]-3-pyridin-2-ylpropanamide
CID 45227413
N-(1-benzylpiperidin-3-yl)-3-phenylpropanamide
CID 42958724
N-[1-(2-phenylethyl)piperidin-3-yl]-3-(1H-pyrazol-4-yl)propanamide
CID 45241321
2-(4-acetylphenoxy)-N-[1-(2-phenylethyl)piperidin-3-yl]acetamide
CID 56715324
3-(furan-2-yl)-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide
CID 45244355
4-oxo-4-phenyl-N-[1-(3-phenylpropyl)piperidin-3-yl]butanamide
CID 56702621
3-(2-oxoazepan-1-yl)-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide
CID 45228344
N-[(3S)-1-(2-phenylethyl)piperidin-3-yl]-3-(1,2,4-triazol-1-yl)propanamide
CID 25378372
3-(2-oxoazepan-1-yl)-N-[(3R)-1-(2-phenylethyl)piperidin-3-yl]propanamide
CID 26318438
4-(2-oxopyrrolidin-1-yl)-N-[(3S)-1-(2-phenylethyl)piperidin-3-yl]butanamide
CID 25480080
N-[1-(2,3-dihydro-1H-inden-2-yl)piperidin-3-yl]-3-phenoxypropanamide
CID 45200396
N-[(3R)-1-(2-phenylethyl)piperidin-3-yl]-2-pyridin-2-ylsulfanylacetamide
CID 26403604

Frequently Asked Questions

What is the IUPAC name of 3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide?
The IUPAC name of 3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide (CID 56853055) is 3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide.
What is the SMILES notation for 3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide?
The canonical SMILES for 3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide is O=C(CCOc1ccccc1)NC1CCCN(CCc2ccccc2)C1.
What is the InChIKey of 3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide?
The InChIKey is YRENOPYDPVIGQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O2/c25-22(14-17-26-21-11-5-2-6-12-21)23-20-10-7-15-24(18-20)16-13-19-8-3-1-4-9-19/h1-6,8-9,11-12,20H,7,10,13-18H2,(H,23,25).
What are the key properties of 3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide?
3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide has a molecular weight of 352.48 g/mol, XLogP of 3.28, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenoxy-N-[1-(2-phenylethyl)piperidin-3-yl]propanamide is sourced from PubChem (CID 56853055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).