4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide

C18H24N2O2 — CID 110198053

IUPAC4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide
SMILESCC(=O)N1CCC(Cc2ccc(C(=O)NC3CC3)cc2)CC1
InChIInChI=1S/C18H24N2O2/c1-13(21)20-10-8-15(9-11-20)12-14-2-4-16(5-3-14)18(22)19-17-6-7-17/h2-5,15,17H,6-12H2,1H3,(H,19,22)
InChIKeyDUSJLPQKYVMCIQ-UHFFFAOYSA-N
MW300.40 g/mol
LogP2.38
Rot. Bonds4

About 4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide

4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide (PubChem CID 110198053) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide.

Molecular Properties

Compound Name4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide
PubChem CID110198053
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide
SMILESCC(=O)N1CCC(Cc2ccc(C(=O)NC3CC3)cc2)CC1
InChIInChI=1S/C18H24N2O2/c1-13(21)20-10-8-15(9-11-20)12-14-2-4-16(5-3-14)18(22)19-17-6-7-17/h2-5,15,17H,6-12H2,1H3,(H,19,22)
InChIKeyDUSJLPQKYVMCIQ-UHFFFAOYSA-N
XLogP2.38
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide 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

4-[(1-acetylpiperidin-4-yl)methyl]-N-ethylbenzamide
CID 110198056
N-(1-acetylpiperidin-4-yl)-4-cyanobenzamide
CID 17463259
N-(1-acetylpiperidin-4-yl)-4-(2,5-dimethylpyrrol-1-yl)benzamide
CID 51221242
acetic acid;4-[[1-(1-aminocyclopentanecarbonyl)pyrrolidin-3-yl]methyl]-N-(oxan-4-yl)benzamide
CID 171712512
N-(1-acetylpyrrolidin-3-yl)-4-fluorobenzamide
CID 110871339
N-cyclopropyl-4-(piperidin-1-ylmethyl)benzamide
CID 17407709
ethyl 4-[[4-[(1-ethoxycarbonylpiperidin-4-yl)carbamoyl]benzoyl]amino]piperidine-1-carboxylate
CID 24644255
3-[(4-benzylpiperidin-1-yl)methyl]-N-cyclopropylbenzamide
CID 42850889
4-methyl-N-[1-[3-(4-methylphenyl)propanoyl]piperidin-4-yl]benzamide
CID 108549141
4-(4-acetylpiperazin-1-yl)sulfonyl-N-(1-propylpiperidin-4-yl)benzamide
CID 55407115
1-[4-[(4-propan-2-ylsulfanylphenyl)methyl]piperidin-1-yl]ethanone
CID 18538586
4-[(dimethylamino)methyl]-N-(4-hydroxycyclohexyl)benzamide
CID 43393996

Frequently Asked Questions

What is the IUPAC name of 4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide?
The IUPAC name of 4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide (CID 110198053) is 4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide.
What is the SMILES notation for 4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide?
The canonical SMILES for 4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide is CC(=O)N1CCC(Cc2ccc(C(=O)NC3CC3)cc2)CC1.
What is the InChIKey of 4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide?
The InChIKey is DUSJLPQKYVMCIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-13(21)20-10-8-15(9-11-20)12-14-2-4-16(5-3-14)18(22)19-17-6-7-17/h2-5,15,17H,6-12H2,1H3,(H,19,22).
What are the key properties of 4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide?
4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide has a molecular weight of 300.40 g/mol, XLogP of 2.38, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-acetylpiperidin-4-yl)methyl]-N-cyclopropylbenzamide is sourced from PubChem (CID 110198053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).