N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide

C22H25N3O3 — CID 108551288

IUPACN-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide
SMILESCC(=O)Nc1cccc(C(=O)N2CCC(NC(=O)Cc3ccccc3)CC2)c1
InChIInChI=1S/C22H25N3O3/c1-16(26)23-20-9-5-8-18(15-20)22(28)25-12-10-19(11-13-25)24-21(27)14-17-6-3-2-4-7-17/h2-9,15,19H,10-14H2,1H3,(H,23,26)(H,24,27)
InChIKeyACXRIYBQFYMEPI-UHFFFAOYSA-N
MW379.46 g/mol
LogP2.61
Rot. Bonds5

About N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide

N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide (PubChem CID 108551288) has the molecular formula C22H25N3O3 and a molecular weight of 379.46 g/mol. Its IUPAC name is N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide
PubChem CID108551288
Molecular FormulaC22H25N3O3
Molecular Weight379.46 g/mol
Exact Mass379.19
IUPAC NameN-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide
SMILESCC(=O)Nc1cccc(C(=O)N2CCC(NC(=O)Cc3ccccc3)CC2)c1
InChIInChI=1S/C22H25N3O3/c1-16(26)23-20-9-5-8-18(15-20)22(28)25-12-10-19(11-13-25)24-21(27)14-17-6-3-2-4-7-17/h2-9,15,19H,10-14H2,1H3,(H,23,26)(H,24,27)
InChIKeyACXRIYBQFYMEPI-UHFFFAOYSA-N
XLogP2.61
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-ethylbutanamide
CID 108555614
N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide
CID 108551244
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-(1-adamantyl)acetamide
CID 108550975
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-hydroxybenzamide
CID 108551397
N-[1-(3,4-dichlorobenzoyl)piperidin-4-yl]-2-phenylacetamide
CID 108551233
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
CID 108558184
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-fluorobenzamide
CID 32508951
2-chloroethyl N-[1-(3-acetamidobenzoyl)piperidin-4-yl]carbamate
CID 108565532
4-(3-acetamidobenzoyl)-N-cyclopentylpiperazine-1-carboxamide
CID 110812202
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-4-methoxybenzamide
CID 108548929
4-(3-acetamidobenzoyl)-N-benzylpiperazine-1-carboxamide
CID 110365652
N-[1-(4-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide
CID 108551232

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide?
The IUPAC name of N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide (CID 108551288) is N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide.
What is the SMILES notation for N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide?
The canonical SMILES for N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide is CC(=O)Nc1cccc(C(=O)N2CCC(NC(=O)Cc3ccccc3)CC2)c1.
What is the InChIKey of N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide?
The InChIKey is ACXRIYBQFYMEPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O3/c1-16(26)23-20-9-5-8-18(15-20)22(28)25-12-10-19(11-13-25)24-21(27)14-17-6-3-2-4-7-17/h2-9,15,19H,10-14H2,1H3,(H,23,26)(H,24,27).
What are the key properties of N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide?
N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide has a molecular weight of 379.46 g/mol, XLogP of 2.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-acetamidobenzoyl)piperidin-4-yl]-2-phenylacetamide is sourced from PubChem (CID 108551288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).