N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide

C21H23N3O3 — CID 12608588

IUPACN-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide
SMILESO=C(NC(=O)c1ccccc1)NC1CCN(CC(=O)c2ccccc2)CC1
InChIInChI=1S/C21H23N3O3/c25-19(16-7-3-1-4-8-16)15-24-13-11-18(12-14-24)22-21(27)23-20(26)17-9-5-2-6-10-17/h1-10,18H,11-15H2,(H2,22,23,26,27)
InChIKeyBHWWZZSFCHHZGH-UHFFFAOYSA-N
MW365.43 g/mol
LogP2.47
Rot. Bonds5

About N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide

N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide (PubChem CID 12608588) has the molecular formula C21H23N3O3 and a molecular weight of 365.43 g/mol. Its IUPAC name is N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide.

Molecular Properties

Compound NameN-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide
PubChem CID12608588
Molecular FormulaC21H23N3O3
Molecular Weight365.43 g/mol
Exact Mass365.17
IUPAC NameN-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide
SMILESO=C(NC(=O)c1ccccc1)NC1CCN(CC(=O)c2ccccc2)CC1
InChIInChI=1S/C21H23N3O3/c25-19(16-7-3-1-4-8-16)15-24-13-11-18(12-14-24)22-21(27)23-20(26)17-9-5-2-6-10-17/h1-10,18H,11-15H2,(H2,22,23,26,27)
InChIKeyBHWWZZSFCHHZGH-UHFFFAOYSA-N
XLogP2.47
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.43
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(piperidin-4-ylcarbamoyl)benzamide
CID 12608582
tert-butyl 4-(benzoylcarbamoylamino)piperidine-1-carboxylate
CID 58602980
2-(bromomethyl)naphthalene;N-[[1-(naphthalen-2-ylmethyl)piperidin-4-yl]carbamoyl]benzamide
CID 159218719
2-(4-benzoylpiperazin-1-yl)-N-(cyclopropylcarbamoyl)acetamide
CID 9223376
N-[1-[2-[4-(2-methylcyclobutyl)piperazin-1-yl]-2-oxoethyl]piperidin-4-yl]benzamide
CID 143404085
1-cyclohexyl-3-[1-(4-oxo-4-phenylbutyl)piperidin-4-yl]urea
CID 12940306
N-[1-[2-(1-ethyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl]piperidin-4-yl]benzamide
CID 33108267
N-[1-[2-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl]piperidin-4-yl]benzamide
CID 16580800
N-[1-(2-cyclohexylethyl)piperidin-4-yl]benzamide
CID 21413269
2-[4-(oxiran-2-yl)piperidin-1-yl]-1-phenylethanone
CID 59305185
N-[(1-phenacylpiperidin-4-yl)methyl]acetamide
CID 102736676
2-(4-benzoylpiperazin-1-yl)-1-phenylethanone
CID 3599210

Frequently Asked Questions

What is the IUPAC name of N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide?
The IUPAC name of N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide (CID 12608588) is N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide.
What is the SMILES notation for N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide?
The canonical SMILES for N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide is O=C(NC(=O)c1ccccc1)NC1CCN(CC(=O)c2ccccc2)CC1.
What is the InChIKey of N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide?
The InChIKey is BHWWZZSFCHHZGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O3/c25-19(16-7-3-1-4-8-16)15-24-13-11-18(12-14-24)22-21(27)23-20(26)17-9-5-2-6-10-17/h1-10,18H,11-15H2,(H2,22,23,26,27).
What are the key properties of N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide?
N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide has a molecular weight of 365.43 g/mol, XLogP of 2.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-phenacylpiperidin-4-yl)carbamoyl]benzamide is sourced from PubChem (CID 12608588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).