1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea

C19H28N4O4 — CID 22577970

IUPAC1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea
SMILESCCOCCCNC(=O)Nc1ncc(-c2cccc(OC)c2)n1CCOC
InChIInChI=1S/C19H28N4O4/c1-4-27-11-6-9-20-19(24)22-18-21-14-17(23(18)10-12-25-2)15-7-5-8-16(13-15)26-3/h5,7-8,13-14H,4,6,9-12H2,1-3H3,(H2,20,21,22,24)
InChIKeyOFPWLMYVUAJNNI-UHFFFAOYSA-N
MW376.46 g/mol
LogP2.75
Rot. Bonds11

About 1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea

1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea (PubChem CID 22577970) has the molecular formula C19H28N4O4 and a molecular weight of 376.46 g/mol. Its IUPAC name is 1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea.

Molecular Properties

Compound Name1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea
PubChem CID22577970
Molecular FormulaC19H28N4O4
Molecular Weight376.46 g/mol
Exact Mass376.21
IUPAC Name1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea
SMILESCCOCCCNC(=O)Nc1ncc(-c2cccc(OC)c2)n1CCOC
InChIInChI=1S/C19H28N4O4/c1-4-27-11-6-9-20-19(24)22-18-21-14-17(23(18)10-12-25-2)15-7-5-8-16(13-15)26-3/h5,7-8,13-14H,4,6,9-12H2,1-3H3,(H2,20,21,22,24)
InChIKeyOFPWLMYVUAJNNI-UHFFFAOYSA-N
XLogP2.75
TPSA86.64 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea 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

1-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]-3-phenylurea
CID 22577953
1-(3-chlorophenyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea
CID 22577951
1-(2,3-dimethylphenyl)-3-[1-(2-methoxyethyl)-5-(4-methoxyphenyl)imidazol-2-yl]urea
CID 22577946
N-(3-ethoxypropyl)-4-[2-(3-methoxyphenoxy)pyrimidin-5-yl]benzamide
CID 53116703
N-(3-ethoxypropyl)-3-(3-methoxyphenyl)-1-phenylpyrazole-4-carboxamide
CID 43016952
N-(3-ethoxypropyl)-1-[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]cyclopropane-1-carboxamide
CID 90503720
N-(3-ethoxypropyl)-2-(3-methoxyphenyl)sulfanylpropanamide
CID 75869890
N-(3-ethoxypropyl)-4-[6-(3-methoxyphenoxy)pyrimidin-4-yl]benzamide
CID 53021136
N-(3-ethoxypropyl)-2-[3-[(3-methoxybenzoyl)amino]propanoylamino]benzamide
CID 17226286
1-(5-ethoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)-3-(3-methoxypropyl)urea
CID 53204590
5-(3-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-1-methylimidazol-2-amine;oxalic acid
CID 126468009
3-(3-methoxyphenyl)-1-(4-methoxyphenyl)-N-(3-methoxypropyl)pyrazole-5-carboxamide
CID 4553947

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea?
The IUPAC name of 1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea (CID 22577970) is 1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea.
What is the SMILES notation for 1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea?
The canonical SMILES for 1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea is CCOCCCNC(=O)Nc1ncc(-c2cccc(OC)c2)n1CCOC.
What is the InChIKey of 1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea?
The InChIKey is OFPWLMYVUAJNNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O4/c1-4-27-11-6-9-20-19(24)22-18-21-14-17(23(18)10-12-25-2)15-7-5-8-16(13-15)26-3/h5,7-8,13-14H,4,6,9-12H2,1-3H3,(H2,20,21,22,24).
What are the key properties of 1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea?
1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea has a molecular weight of 376.46 g/mol, XLogP of 2.75, 11 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea is sourced from PubChem (CID 22577970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).