N-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide

C18H25N3O2 — CID 8962755

IUPACN-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide
SMILESO=C1CN(CC(=O)N(c2ccccc2)C2CCCCC2)CCN1
InChIInChI=1S/C18H25N3O2/c22-17-13-20(12-11-19-17)14-18(23)21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1,3-4,7-8,16H,2,5-6,9-14H2,(H,19,22)
InChIKeyNMQJXZYFOAKPKB-UHFFFAOYSA-N
MW315.42 g/mol
LogP1.78
Rot. Bonds4

About N-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide

N-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide (PubChem CID 8962755) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is N-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide
PubChem CID8962755
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC NameN-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide
SMILESO=C1CN(CC(=O)N(c2ccccc2)C2CCCCC2)CCN1
InChIInChI=1S/C18H25N3O2/c22-17-13-20(12-11-19-17)14-18(23)21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1,3-4,7-8,16H,2,5-6,9-14H2,(H,19,22)
InChIKeyNMQJXZYFOAKPKB-UHFFFAOYSA-N
XLogP1.78
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-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

N-cyclohexyl-N-phenyl-2-piperazin-1-ylacetamide;2,2,2-trifluoroacetic acid
CID 175285258
N,N-dibenzyl-2-(3-oxopiperazin-1-yl)acetamide
CID 8963237
N-cyclohexyl-N-phenyl-2-piperidin-4-ylacetamide
CID 174812391
N-cyclohexyl-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-phenylacetamide
CID 7266331
1-[2-(N-cyclohexylanilino)-2-oxoethyl]-5-methylpiperidine-3-carboxylic acid
CID 122121628
N-cyclohexyl-2-[(1R,2R,6S,7R)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]-N-phenylacetamide
CID 98363739
1-[2-(N-cyclohexylanilino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 57166210
3-[2-(N-cyclohexylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylic acid
CID 16539167
4-[2-[benzyl(cyclohexyl)amino]acetyl]piperazin-2-one
CID 71891023
N-cyclohexyl-2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-phenylacetamide
CID 6993214
N-cyclohexyl-2-[2-[2-(N-cyclohexylanilino)-2-oxoethoxy]phenoxy]-N-phenylacetamide
CID 102017753
4-(2-cyclopentyl-2-oxoethyl)-1,4-diazepan-2-one
CID 104750873

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide?
The IUPAC name of N-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide (CID 8962755) is N-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide.
What is the SMILES notation for N-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide?
The canonical SMILES for N-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide is O=C1CN(CC(=O)N(c2ccccc2)C2CCCCC2)CCN1.
What is the InChIKey of N-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide?
The InChIKey is NMQJXZYFOAKPKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2/c22-17-13-20(12-11-19-17)14-18(23)21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1,3-4,7-8,16H,2,5-6,9-14H2,(H,19,22).
What are the key properties of N-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide?
N-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide has a molecular weight of 315.42 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(3-oxopiperazin-1-yl)-N-phenylacetamide is sourced from PubChem (CID 8962755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).