(2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide

C17H23N3O2 — CID 9033825

IUPAC(2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide
SMILESCC(=O)N1CCN([C@H](C(=O)NC2CC2)c2ccccc2)CC1
InChIInChI=1S/C17H23N3O2/c1-13(21)19-9-11-20(12-10-19)16(14-5-3-2-4-6-14)17(22)18-15-7-8-15/h2-6,15-16H,7-12H2,1H3,(H,18,22)/t16-/m0/s1
InChIKeyCXIZCGULVJWUJW-INIZCTEOSA-N
MW301.39 g/mol
LogP1.17
Rot. Bonds4

About (2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide

(2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide (PubChem CID 9033825) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is (2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide
PubChem CID9033825
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC Name(2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide
SMILESCC(=O)N1CCN([C@H](C(=O)NC2CC2)c2ccccc2)CC1
InChIInChI=1S/C17H23N3O2/c1-13(21)19-9-11-20(12-10-19)16(14-5-3-2-4-6-14)17(22)18-15-7-8-15/h2-6,15-16H,7-12H2,1H3,(H,18,22)/t16-/m0/s1
InChIKeyCXIZCGULVJWUJW-INIZCTEOSA-N
XLogP1.17
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide 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

(2S)-N-cyclopropyl-2-(4-methylpiperazin-1-yl)-2-phenylacetamide
CID 9033055
(2S)-N-cyclopropyl-2-[4-(2-methylphenyl)piperazin-1-yl]-2-phenylacetamide
CID 9029671
(2S)-2-[4-(4-acetylphenyl)piperazin-1-yl]-N-cyclopropyl-2-phenylacetamide
CID 9029338
(2R)-2-(4-acetylpiperazin-1-yl)-2-phenylacetamide
CID 51908871
(2S)-N-cyclopropyl-2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-phenylacetamide
CID 9027643
(2S)-N-cyclopropyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]-2-phenylacetamide
CID 30959081
(2S)-N-cyclopropyl-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-phenylacetamide
CID 51887029
(2R)-N-cyclopropyl-2-phenyl-2-(4-piperidin-1-ylpiperidin-1-yl)acetamide
CID 94797745
N-cyclopropyl-2-[3-(methylamino)piperidin-1-yl]-2-phenylacetamide
CID 119918563
2-(4-methylpiperazin-1-yl)-2-phenyl-N-pyrrolidin-3-ylacetamide;dihydrochloride
CID 119453034
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-(4-methylpiperazin-1-yl)-2-phenylacetamide;dihydrochloride
CID 119458426
ethyl 1-[(1S)-2-(cyclopropylamino)-2-oxo-1-phenylethyl]piperidine-4-carboxylate
CID 9046776

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide?
The IUPAC name of (2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide (CID 9033825) is (2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide.
What is the SMILES notation for (2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide?
The canonical SMILES for (2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide is CC(=O)N1CCN([C@H](C(=O)NC2CC2)c2ccccc2)CC1.
What is the InChIKey of (2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide?
The InChIKey is CXIZCGULVJWUJW-INIZCTEOSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-13(21)19-9-11-20(12-10-19)16(14-5-3-2-4-6-14)17(22)18-15-7-8-15/h2-6,15-16H,7-12H2,1H3,(H,18,22)/t16-/m0/s1.
What are the key properties of (2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide?
(2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide has a molecular weight of 301.39 g/mol, XLogP of 1.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-acetylpiperazin-1-yl)-N-cyclopropyl-2-phenylacetamide is sourced from PubChem (CID 9033825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).