N-(3-methylpiperidin-4-yl)-3-phenoxypropanamide

C15H22N2O2 — CID 79886279

IUPACN-(3-methylpiperidin-4-yl)-3-phenoxypropanamide
SMILESCC1CNCCC1NC(=O)CCOc1ccccc1
InChIInChI=1S/C15H22N2O2/c1-12-11-16-9-7-14(12)17-15(18)8-10-19-13-5-3-2-4-6-13/h2-6,12,14,16H,7-11H2,1H3,(H,17,18)
InChIKeyOKIVFDKGDRYOHC-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.57
Rot. Bonds5

About N-(3-methylpiperidin-4-yl)-3-phenoxypropanamide

N-(3-methylpiperidin-4-yl)-3-phenoxypropanamide (PubChem CID 79886279) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-(3-methylpiperidin-4-yl)-3-phenoxypropanamide.

Molecular Properties

Compound NameN-(3-methylpiperidin-4-yl)-3-phenoxypropanamide
PubChem CID79886279
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-(3-methylpiperidin-4-yl)-3-phenoxypropanamide
SMILESCC1CNCCC1NC(=O)CCOc1ccccc1
InChIInChI=1S/C15H22N2O2/c1-12-11-16-9-7-14(12)17-15(18)8-10-19-13-5-3-2-4-6-13/h2-6,12,14,16H,7-11H2,1H3,(H,17,18)
InChIKeyOKIVFDKGDRYOHC-UHFFFAOYSA-N
XLogP1.57
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-methylpiperidin-4-yl)-3-phenoxypropanamide?
The IUPAC name of N-(3-methylpiperidin-4-yl)-3-phenoxypropanamide (CID 79886279) is N-(3-methylpiperidin-4-yl)-3-phenoxypropanamide.
What is the SMILES notation for N-(3-methylpiperidin-4-yl)-3-phenoxypropanamide?
The canonical SMILES for N-(3-methylpiperidin-4-yl)-3-phenoxypropanamide is CC1CNCCC1NC(=O)CCOc1ccccc1.
What is the InChIKey of N-(3-methylpiperidin-4-yl)-3-phenoxypropanamide?
The InChIKey is OKIVFDKGDRYOHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-12-11-16-9-7-14(12)17-15(18)8-10-19-13-5-3-2-4-6-13/h2-6,12,14,16H,7-11H2,1H3,(H,17,18).
What are the key properties of N-(3-methylpiperidin-4-yl)-3-phenoxypropanamide?
N-(3-methylpiperidin-4-yl)-3-phenoxypropanamide has a molecular weight of 262.35 g/mol, XLogP of 1.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylpiperidin-4-yl)-3-phenoxypropanamide is sourced from PubChem (CID 79886279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).