1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea

C18H20N4O3 — CID 146127243

IUPAC1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea
SMILESCOCC(NC(=O)NCc1ccccc1-n1ccnc1)c1ccco1
InChIInChI=1S/C18H20N4O3/c1-24-12-15(17-7-4-10-25-17)21-18(23)20-11-14-5-2-3-6-16(14)22-9-8-19-13-22/h2-10,13,15H,11-12H2,1H3,(H2,20,21,23)
InChIKeyWYVMAMGGAWZIMJ-UHFFFAOYSA-N
MW340.38 g/mol
LogP2.65
Rot. Bonds7

About 1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea

1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea (PubChem CID 146127243) has the molecular formula C18H20N4O3 and a molecular weight of 340.38 g/mol. Its IUPAC name is 1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea.

Molecular Properties

Compound Name1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea
PubChem CID146127243
Molecular FormulaC18H20N4O3
Molecular Weight340.38 g/mol
Exact Mass340.15
IUPAC Name1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea
SMILESCOCC(NC(=O)NCc1ccccc1-n1ccnc1)c1ccco1
InChIInChI=1S/C18H20N4O3/c1-24-12-15(17-7-4-10-25-17)21-18(23)20-11-14-5-2-3-6-16(14)22-9-8-19-13-22/h2-10,13,15H,11-12H2,1H3,(H2,20,21,23)
InChIKeyWYVMAMGGAWZIMJ-UHFFFAOYSA-N
XLogP2.65
TPSA81.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1-hydroxy-4-methylpentan-3-yl)-3-[(2-imidazol-1-ylphenyl)methyl]urea
CID 111505245
1-[(2-imidazol-1-ylphenyl)methyl]-3-(1-methoxypropan-2-yl)-2-methylguanidine;hydroiodide
CID 111237202
methyl N-[4-[[(2-imidazol-1-ylphenyl)methylcarbamoylamino]methyl]phenyl]carbamate
CID 86838396
1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-3-[(1R)-1-(furan-2-yl)-2-methoxyethyl]urea
CID 97067035
1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-3-[1-(furan-2-yl)-2-methoxyethyl]urea
CID 71865664
1-[(2-imidazol-1-ylphenyl)methyl]-3-(5-methoxy-2-methylphenyl)urea
CID 71970578
2-(2,6-dimethoxyphenyl)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide
CID 136514293
1-(4-fluoro-2-methoxyphenyl)-3-[(2-imidazol-1-ylphenyl)methyl]urea
CID 136578950
1-[1-(furan-2-yl)-2-methoxyethyl]-3-(3-hydroxy-3-phenylpropyl)urea
CID 111566530
1-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-3-[(2-imidazol-1-ylphenyl)methyl]-2-methylguanidine;hydroiodide
CID 111304784
1-[2-(4-chlorophenyl)sulfanylethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea
CID 60580594
(2R)-2-(2-chlorophenoxy)-N-[(2-imidazol-1-ylphenyl)methyl]propanamide
CID 92685089

Frequently Asked Questions

What is the IUPAC name of 1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea?
The IUPAC name of 1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea (CID 146127243) is 1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea.
What is the SMILES notation for 1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea?
The canonical SMILES for 1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea is COCC(NC(=O)NCc1ccccc1-n1ccnc1)c1ccco1.
What is the InChIKey of 1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea?
The InChIKey is WYVMAMGGAWZIMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O3/c1-24-12-15(17-7-4-10-25-17)21-18(23)20-11-14-5-2-3-6-16(14)22-9-8-19-13-22/h2-10,13,15H,11-12H2,1H3,(H2,20,21,23).
What are the key properties of 1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea?
1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea has a molecular weight of 340.38 g/mol, XLogP of 2.65, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(furan-2-yl)-2-methoxyethyl]-3-[(2-imidazol-1-ylphenyl)methyl]urea is sourced from PubChem (CID 146127243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).