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

C20H22N4O3 — CID 22577953

IUPAC1-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]-3-phenylurea
SMILESCOCCn1c(-c2cccc(OC)c2)cnc1NC(=O)Nc1ccccc1
InChIInChI=1S/C20H22N4O3/c1-26-12-11-24-18(15-7-6-10-17(13-15)27-2)14-21-19(24)23-20(25)22-16-8-4-3-5-9-16/h3-10,13-14H,11-12H2,1-2H3,(H2,21,22,23,25)
InChIKeyDHGVKWZQCHWCIA-UHFFFAOYSA-N
MW366.42 g/mol
LogP3.85
Rot. Bonds7

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

1-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]-3-phenylurea (PubChem CID 22577953) has the molecular formula C20H22N4O3 and a molecular weight of 366.42 g/mol. Its IUPAC name is 1-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]-3-phenylurea.

Molecular Properties

Compound Name1-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]-3-phenylurea
PubChem CID22577953
Molecular FormulaC20H22N4O3
Molecular Weight366.42 g/mol
Exact Mass366.17
IUPAC Name1-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]-3-phenylurea
SMILESCOCCn1c(-c2cccc(OC)c2)cnc1NC(=O)Nc1ccccc1
InChIInChI=1S/C20H22N4O3/c1-26-12-11-24-18(15-7-6-10-17(13-15)27-2)14-21-19(24)23-20(25)22-16-8-4-3-5-9-16/h3-10,13-14H,11-12H2,1-2H3,(H2,21,22,23,25)
InChIKeyDHGVKWZQCHWCIA-UHFFFAOYSA-N
XLogP3.85
TPSA77.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-chlorophenyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea
CID 22577951
1-(3-ethoxypropyl)-3-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]urea
CID 22577970
1-(2,3-dimethylphenyl)-3-[1-(2-methoxyethyl)-5-(4-methoxyphenyl)imidazol-2-yl]urea
CID 22577946
1-(2,4-dimethoxyphenyl)-3-(1-methyl-5-phenylimidazol-2-yl)urea
CID 22577919
5-(3-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-1-methylimidazol-2-amine;oxalic acid
CID 126468009
1-(1-ethylbenzimidazol-2-yl)-3-(3-methoxyphenyl)urea
CID 35279970
5-(3-methoxyphenyl)-1-methyl-N-[(3-phenoxyphenyl)methyl]imidazol-2-amine;oxalic acid
CID 163327777
4-chloro-2-[[[1-(2-methoxyethyl)-5-phenylimidazol-2-yl]amino]methyl]phenol;oxalic acid
CID 163327011
5-(3-methoxyphenyl)-1-methyl-N-[(4-methylphenyl)methyl]imidazol-2-amine;oxalic acid
CID 126460185
1-[3-(2-methoxyethyl)-4-oxoquinazolin-6-yl]-3-(3-methoxyphenyl)urea
CID 162429378
3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide
CID 18153307
1-(3-methoxyphenyl)-3-[(5-phenyl-1,3-oxazol-2-yl)methyl]urea
CID 86924588

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]-3-phenylurea?
The IUPAC name of 1-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]-3-phenylurea (CID 22577953) is 1-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]-3-phenylurea.
What is the SMILES notation for 1-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]-3-phenylurea?
The canonical SMILES for 1-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]-3-phenylurea is COCCn1c(-c2cccc(OC)c2)cnc1NC(=O)Nc1ccccc1.
What is the InChIKey of 1-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]-3-phenylurea?
The InChIKey is DHGVKWZQCHWCIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O3/c1-26-12-11-24-18(15-7-6-10-17(13-15)27-2)14-21-19(24)23-20(25)22-16-8-4-3-5-9-16/h3-10,13-14H,11-12H2,1-2H3,(H2,21,22,23,25).
What are the key properties of 1-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]-3-phenylurea?
1-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]-3-phenylurea has a molecular weight of 366.42 g/mol, XLogP of 3.85, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-methoxyethyl)-5-(3-methoxyphenyl)imidazol-2-yl]-3-phenylurea is sourced from PubChem (CID 22577953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).