N-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide

C14H17ClN4O3 — CID 7181002

IUPACN-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide
SMILESCCC1(CC)NC(=O)N(CC(=O)Nc2cccnc2Cl)C1=O
InChIInChI=1S/C14H17ClN4O3/c1-3-14(4-2)12(21)19(13(22)18-14)8-10(20)17-9-6-5-7-16-11(9)15/h5-7H,3-4,8H2,1-2H3,(H,17,20)(H,18,22)
InChIKeyAFRKNGUWSNVRFM-UHFFFAOYSA-N
MW324.77 g/mol
LogP1.78
Rot. Bonds5

About N-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide

N-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide (PubChem CID 7181002) has the molecular formula C14H17ClN4O3 and a molecular weight of 324.77 g/mol. Its IUPAC name is N-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide
PubChem CID7181002
Molecular FormulaC14H17ClN4O3
Molecular Weight324.77 g/mol
Exact Mass324.10
IUPAC NameN-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide
SMILESCCC1(CC)NC(=O)N(CC(=O)Nc2cccnc2Cl)C1=O
InChIInChI=1S/C14H17ClN4O3/c1-3-14(4-2)12(21)19(13(22)18-14)8-10(20)17-9-6-5-7-16-11(9)15/h5-7H,3-4,8H2,1-2H3,(H,17,20)(H,18,22)
InChIKeyAFRKNGUWSNVRFM-UHFFFAOYSA-N
XLogP1.78
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.77
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze N-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide 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

2-[(4S)-4-(2-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2-chloro-3-pyridinyl)acetamide
CID 8011862
N-(2-chloro-3-pyridinyl)-2-[4-(3,4-dichlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 46638569
N-(3-chloro-2-ethoxyphenyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 51124680
2-[4-(3-bromophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2-chloro-3-pyridinyl)acetamide
CID 24819931
N-(2-chloro-3-pyridinyl)-2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)acetamide
CID 4289491
N-(2-chloro-3-pyridinyl)-2-[(4S)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7962023
2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 51177673
N-(4-acetamidophenyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 7181137
2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(4-propan-2-ylphenyl)acetamide
CID 2436338
N-(3-bromophenyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 2708881
2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-(2-methylsulfanylphenyl)acetamide
CID 7242029
N,2-bis(2-chloro-3-pyridinyl)acetamide
CID 139691100

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide?
The IUPAC name of N-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide (CID 7181002) is N-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide.
What is the SMILES notation for N-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide?
The canonical SMILES for N-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide is CCC1(CC)NC(=O)N(CC(=O)Nc2cccnc2Cl)C1=O.
What is the InChIKey of N-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide?
The InChIKey is AFRKNGUWSNVRFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN4O3/c1-3-14(4-2)12(21)19(13(22)18-14)8-10(20)17-9-6-5-7-16-11(9)15/h5-7H,3-4,8H2,1-2H3,(H,17,20)(H,18,22).
What are the key properties of N-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide?
N-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide has a molecular weight of 324.77 g/mol, XLogP of 1.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide is sourced from PubChem (CID 7181002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).