2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide

C19H26ClN3O2 — CID 87049900

IUPAC2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide
SMILESO=C(CN1CCN(Cc2cccc(Cl)c2)C1=O)NCC1CCCCC1
InChIInChI=1S/C19H26ClN3O2/c20-17-8-4-7-16(11-17)13-22-9-10-23(19(22)25)14-18(24)21-12-15-5-2-1-3-6-15/h4,7-8,11,15H,1-3,5-6,9-10,12-14H2,(H,21,24)
InChIKeyYSPRJIZNYFKHDW-UHFFFAOYSA-N
MW363.89 g/mol
LogP3.27
Rot. Bonds6

About 2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide

2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide (PubChem CID 87049900) has the molecular formula C19H26ClN3O2 and a molecular weight of 363.89 g/mol. Its IUPAC name is 2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide.

Molecular Properties

Compound Name2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide
PubChem CID87049900
Molecular FormulaC19H26ClN3O2
Molecular Weight363.89 g/mol
Exact Mass363.17
IUPAC Name2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide
SMILESO=C(CN1CCN(Cc2cccc(Cl)c2)C1=O)NCC1CCCCC1
InChIInChI=1S/C19H26ClN3O2/c20-17-8-4-7-16(11-17)13-22-9-10-23(19(22)25)14-18(24)21-12-15-5-2-1-3-6-15/h4,7-8,11,15H,1-3,5-6,9-10,12-14H2,(H,21,24)
InChIKeyYSPRJIZNYFKHDW-UHFFFAOYSA-N
XLogP3.27
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.89
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-benzylpiperazin-1-yl)-N-(cyclohexylmethyl)acetamide
CID 31127901
N-cyclopentyl-2-[3-[(3-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide
CID 3575531
2-(3-benzyl-2-oxoimidazolidin-1-yl)-N-cyclopropylacetamide
CID 91653850
N-[(3-chlorocyclohexyl)methyl]-2-(3-chlorophenyl)acetamide
CID 106132016
N-(cyclohexylmethyl)-2-methyl-4-[(3-methylphenyl)methyl]-3-oxopiperazine-1-carboxamide
CID 119065622
N-[[1-[2-(3-chlorophenyl)acetyl]piperidin-4-yl]methyl]-2-cyanoacetamide
CID 108922209
N-(3-methylbutyl)-2-[3-[(3-methylphenyl)methyl]-2-oxoimidazolidin-1-yl]acetamide
CID 4095945
N-(cycloheptylmethyl)-2-phenylacetamide
CID 54313529
1-[(3-chlorophenyl)methyl]azocane-2-carboxylic acid
CID 114239898
2-[(3R,6aS,8R,10aS)-1-[(3-chlorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(cyclohexylmethyl)acetamide
CID 54657939
2-[(3R,6aR,8R,10aR)-1-[(3-chlorophenyl)methyl]-3-hydroxy-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-(cyclohexylmethyl)acetamide
CID 54657938
3-(3-chlorophenyl)-N-[[1-(2-cyanoacetyl)piperidin-4-yl]methyl]propanamide
CID 108922236

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide?
The IUPAC name of 2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide (CID 87049900) is 2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide.
What is the SMILES notation for 2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide?
The canonical SMILES for 2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide is O=C(CN1CCN(Cc2cccc(Cl)c2)C1=O)NCC1CCCCC1.
What is the InChIKey of 2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide?
The InChIKey is YSPRJIZNYFKHDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26ClN3O2/c20-17-8-4-7-16(11-17)13-22-9-10-23(19(22)25)14-18(24)21-12-15-5-2-1-3-6-15/h4,7-8,11,15H,1-3,5-6,9-10,12-14H2,(H,21,24).
What are the key properties of 2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide?
2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide has a molecular weight of 363.89 g/mol, XLogP of 3.27, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(3-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-(cyclohexylmethyl)acetamide is sourced from PubChem (CID 87049900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).