2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide

C22H26N2O4 — CID 108549234

IUPAC2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide
SMILESCOc1ccccc1C(=O)NC1CCN(C(=O)CCOc2ccccc2)CC1
InChIInChI=1S/C22H26N2O4/c1-27-20-10-6-5-9-19(20)22(26)23-17-11-14-24(15-12-17)21(25)13-16-28-18-7-3-2-4-8-18/h2-10,17H,11-16H2,1H3,(H,23,26)
InChIKeyJEUMHNGUXJVVCM-UHFFFAOYSA-N
MW382.46 g/mol
LogP2.89
Rot. Bonds7

About 2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide

2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide (PubChem CID 108549234) has the molecular formula C22H26N2O4 and a molecular weight of 382.46 g/mol. Its IUPAC name is 2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide
PubChem CID108549234
Molecular FormulaC22H26N2O4
Molecular Weight382.46 g/mol
Exact Mass382.19
IUPAC Name2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide
SMILESCOc1ccccc1C(=O)NC1CCN(C(=O)CCOc2ccccc2)CC1
InChIInChI=1S/C22H26N2O4/c1-27-20-10-6-5-9-19(20)22(26)23-17-11-14-24(15-12-17)21(25)13-16-28-18-7-3-2-4-8-18/h2-10,17H,11-16H2,1H3,(H,23,26)
InChIKeyJEUMHNGUXJVVCM-UHFFFAOYSA-N
XLogP2.89
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.46
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide
CID 39512486
2-fluoro-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide
CID 108549375
4-methyl-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide
CID 108549132
N-[1-(3-cyclohexylpropanoyl)piperidin-4-yl]-2-methoxybenzamide
CID 108549239
2,5-dichloro-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide
CID 108554611
N-[1-(3-methoxypropanoyl)piperidin-4-yl]-4-phenoxybutanamide
CID 108553641
N-[1-[3-(3,4-dimethoxyphenyl)propanoyl]piperidin-4-yl]-2-methoxybenzamide
CID 108549245
N-(1-methylpiperidin-4-yl)-2-(2-phenoxyethoxy)benzamide
CID 78809424
N-[1-(3-phenoxypropanoyl)piperidin-4-yl]butanamide
CID 110820896
2-phenoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]acetamide
CID 108555833
N-[1-(3-phenoxypropanoyl)piperidin-4-yl]-2,2-diphenylacetamide
CID 108549605
4-(4-methylphenoxy)-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]butanamide
CID 108553445

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide?
The IUPAC name of 2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide (CID 108549234) is 2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide.
What is the SMILES notation for 2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide?
The canonical SMILES for 2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide is COc1ccccc1C(=O)NC1CCN(C(=O)CCOc2ccccc2)CC1.
What is the InChIKey of 2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide?
The InChIKey is JEUMHNGUXJVVCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O4/c1-27-20-10-6-5-9-19(20)22(26)23-17-11-14-24(15-12-17)21(25)13-16-28-18-7-3-2-4-8-18/h2-10,17H,11-16H2,1H3,(H,23,26).
What are the key properties of 2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide?
2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide has a molecular weight of 382.46 g/mol, XLogP of 2.89, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 108549234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).