N-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide

C15H20ClN3O2 — CID 75119542

IUPACN-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide
SMILESCCCC1CC(=O)N(CC(=O)Nc2ccc(Cl)cc2)CN1
InChIInChI=1S/C15H20ClN3O2/c1-2-3-13-8-15(21)19(10-17-13)9-14(20)18-12-6-4-11(16)5-7-12/h4-7,13,17H,2-3,8-10H2,1H3,(H,18,20)
InChIKeyRITWECUFNHHWEL-UHFFFAOYSA-N
MW309.80 g/mol
LogP2.23
Rot. Bonds5

About N-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide

N-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide (PubChem CID 75119542) has the molecular formula C15H20ClN3O2 and a molecular weight of 309.80 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide
PubChem CID75119542
Molecular FormulaC15H20ClN3O2
Molecular Weight309.80 g/mol
Exact Mass309.12
IUPAC NameN-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide
SMILESCCCC1CC(=O)N(CC(=O)Nc2ccc(Cl)cc2)CN1
InChIInChI=1S/C15H20ClN3O2/c1-2-3-13-8-15(21)19(10-17-13)9-14(20)18-12-6-4-11(16)5-7-12/h4-7,13,17H,2-3,8-10H2,1H3,(H,18,20)
InChIKeyRITWECUFNHHWEL-UHFFFAOYSA-N
XLogP2.23
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.80
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide
CID 75119560
4-[[2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetyl]amino]benzamide
CID 75119592
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide
CID 75119478
N-(5-acetamido-2-methoxyphenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide
CID 75119601
N-(4-chlorophenyl)-2-(4-ethyl-2,3-dioxopiperazin-1-yl)acetamide
CID 7190167
2-[4-(4-chlorophenyl)-6-oxo-1,3-diazinan-1-yl]-N-(2,5-dichlorophenyl)acetamide
CID 85477526
2-[4-(4-chlorophenyl)-6-oxo-1,3-diazinan-1-yl]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 85477520
N-benzyl-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)-N-phenylacetamide
CID 75119564
N-(4-aminophenyl)-2-(4-methyl-2-oxopyrrolidin-1-yl)acetamide
CID 63103199
N-(4-chlorophenyl)-2-(3-methylpiperazin-1-yl)acetamide;hydrochloride
CID 119924493
2-(3-amino-2-oxo-1,3-diazinan-1-yl)-N-(4-chlorophenyl)acetamide
CID 104601172
2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-(4-fluorophenyl)acetamide
CID 79355559

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide (CID 75119542) is N-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide is CCCC1CC(=O)N(CC(=O)Nc2ccc(Cl)cc2)CN1.
What is the InChIKey of N-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide?
The InChIKey is RITWECUFNHHWEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3O2/c1-2-3-13-8-15(21)19(10-17-13)9-14(20)18-12-6-4-11(16)5-7-12/h4-7,13,17H,2-3,8-10H2,1H3,(H,18,20).
What are the key properties of N-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide?
N-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide has a molecular weight of 309.80 g/mol, XLogP of 2.23, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-(6-oxo-4-propyl-1,3-diazinan-1-yl)acetamide is sourced from PubChem (CID 75119542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).