N-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide

C16H20ClN3O3 — CID 2958006

IUPACN-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide
SMILESCCN1C(=O)C(CC(=O)NCc2ccc(Cl)cc2)N(CC)C1=O
InChIInChI=1S/C16H20ClN3O3/c1-3-19-13(15(22)20(4-2)16(19)23)9-14(21)18-10-11-5-7-12(17)8-6-11/h5-8,13H,3-4,9-10H2,1-2H3,(H,18,21)
InChIKeyOBJFBMMWJFWKPO-UHFFFAOYSA-N
MW337.81 g/mol
LogP2.02
Rot. Bonds6

About N-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide

N-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide (PubChem CID 2958006) has the molecular formula C16H20ClN3O3 and a molecular weight of 337.81 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide
PubChem CID2958006
Molecular FormulaC16H20ClN3O3
Molecular Weight337.81 g/mol
Exact Mass337.12
IUPAC NameN-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide
SMILESCCN1C(=O)C(CC(=O)NCc2ccc(Cl)cc2)N(CC)C1=O
InChIInChI=1S/C16H20ClN3O3/c1-3-19-13(15(22)20(4-2)16(19)23)9-14(21)18-10-11-5-7-12(17)8-6-11/h5-8,13H,3-4,9-10H2,1-2H3,(H,18,21)
InChIKeyOBJFBMMWJFWKPO-UHFFFAOYSA-N
XLogP2.02
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.81
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-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

Ono-1603
CID 9797271
Uamc00039
CID 11232124
2,4-Imidazolidinedione, 5-(p-chlorophenyl)-
CID 97124
Gsk1370319A
CID 67461788
(4S)-N-[[2-chloro-3-(trifluoromethyl)phenyl]methyl]-1,3-dimethyl-2-oxoimidazolidine-4-carboxamide
CID 52944502
N-(3-chlorobenzyl)-1-(4-methylpentanoyl)-L-prolinamide
CID 42615253
2-(4-chlorophenyl)-2-{[(2,5-dioxoimidazolidin-4-yl)acetyl]amino}-N-(3-ethoxypropyl)acetamide
CID 3236607
(S)-2-Amino-4-[(4-chloro-benzyl)-methyl-amino]-1-piperidin-1-yl-butan-1-one
CID 10019118
(S)-2-Amino-4-(4-chloro-benzylamino)-1-(4-methyl-piperidin-1-yl)-butan-1-one
CID 10403949
(2S,4S)-4-(4-chlorobenzylamino)-2-amino-1-(piperidin-1-yl)pentan-1-one
CID 16046127
N-[(4-chlorophenyl)methyl]-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide
CID 2083685
N-[(4-chlorophenyl)methyl]-2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)acetamide
CID 2102967

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide (CID 2958006) is N-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide is CCN1C(=O)C(CC(=O)NCc2ccc(Cl)cc2)N(CC)C1=O.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide?
The InChIKey is OBJFBMMWJFWKPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20ClN3O3/c1-3-19-13(15(22)20(4-2)16(19)23)9-14(21)18-10-11-5-7-12(17)8-6-11/h5-8,13H,3-4,9-10H2,1-2H3,(H,18,21).
What are the key properties of N-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide?
N-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide has a molecular weight of 337.81 g/mol, XLogP of 2.02, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-2-(1,3-diethyl-2,5-dioxoimidazolidin-4-yl)acetamide is sourced from PubChem (CID 2958006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).