N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide

C22H25N3O4 — CID 108548929

IUPACN-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CCN(C(=O)c3cccc(NC(C)=O)c3)CC2)cc1
InChIInChI=1S/C22H25N3O4/c1-15(26)23-19-5-3-4-17(14-19)22(28)25-12-10-18(11-13-25)24-21(27)16-6-8-20(29-2)9-7-16/h3-9,14,18H,10-13H2,1-2H3,(H,23,26)(H,24,27)
InChIKeyJVNRHSNPUNNDCN-UHFFFAOYSA-N
MW395.46 g/mol
LogP2.69
Rot. Bonds5

About N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide

N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide (PubChem CID 108548929) has the molecular formula C22H25N3O4 and a molecular weight of 395.46 g/mol. Its IUPAC name is N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide
PubChem CID108548929
Molecular FormulaC22H25N3O4
Molecular Weight395.46 g/mol
Exact Mass395.18
IUPAC NameN-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)NC2CCN(C(=O)c3cccc(NC(C)=O)c3)CC2)cc1
InChIInChI=1S/C22H25N3O4/c1-15(26)23-19-5-3-4-17(14-19)22(28)25-12-10-18(11-13-25)24-21(27)16-6-8-20(29-2)9-7-16/h3-9,14,18H,10-13H2,1-2H3,(H,23,26)(H,24,27)
InChIKeyJVNRHSNPUNNDCN-UHFFFAOYSA-N
XLogP2.69
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.46
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetylphenyl)-4-[(4-methoxybenzoyl)amino]piperidine-1-carboxamide
CID 43814135
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-fluorobenzamide
CID 32508951
N-[3-[4-(4-methoxybenzoyl)piperidine-1-carbonyl]phenyl]acetamide
CID 25474514
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
CID 108558184
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide
CID 108551397
N-[1-(3,5-dihydroxybenzoyl)piperidin-4-yl]-4-methoxybenzamide
CID 108548966
4-methoxy-N-[1-(4-phenylbenzoyl)piperidin-4-yl]benzamide
CID 108548880
3-acetamido-N-[1-[2-(4-hydroxyphenoxy)propanoyl]piperidin-4-yl]benzamide
CID 108553820
3-acetamido-N-[1-(3-methoxypropanoyl)piperidin-4-yl]benzamide
CID 108553862
N-[1-(4-tert-butylbenzoyl)piperidin-4-yl]-3-methoxybenzamide
CID 108550355
3-hydroxy-N-[1-(3-methoxybenzoyl)piperidin-4-yl]benzamide
CID 108558264
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-ethylbutanamide
CID 108555614

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide?
The IUPAC name of N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide (CID 108548929) is N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide.
What is the SMILES notation for N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide?
The canonical SMILES for N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide is COc1ccc(C(=O)NC2CCN(C(=O)c3cccc(NC(C)=O)c3)CC2)cc1.
What is the InChIKey of N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide?
The InChIKey is JVNRHSNPUNNDCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O4/c1-15(26)23-19-5-3-4-17(14-19)22(28)25-12-10-18(11-13-25)24-21(27)16-6-8-20(29-2)9-7-16/h3-9,14,18H,10-13H2,1-2H3,(H,23,26)(H,24,27).
What are the key properties of N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide?
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide has a molecular weight of 395.46 g/mol, XLogP of 2.69, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide is sourced from PubChem (CID 108548929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).