5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine

C26H26FN3O2 — CID 4539990

IUPAC5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine
SMILESCOCCn1c(-c2ccc(F)cc2)cnc1NCc1cccc(OCc2ccccc2)c1
InChIInChI=1S/C26H26FN3O2/c1-31-15-14-30-25(22-10-12-23(27)13-11-22)18-29-26(30)28-17-21-8-5-9-24(16-21)32-19-20-6-3-2-4-7-20/h2-13,16,18H,14-15,17,19H2,1H3,(H,28,29)
InChIKeyZXVAZVILQOWDSX-UHFFFAOYSA-N
MW431.51 g/mol
LogP5.53
Rot. Bonds10

About 5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine

5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine (PubChem CID 4539990) has the molecular formula C26H26FN3O2 and a molecular weight of 431.51 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine.

Molecular Properties

Compound Name5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine
PubChem CID4539990
Molecular FormulaC26H26FN3O2
Molecular Weight431.51 g/mol
Exact Mass431.20
IUPAC Name5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine
SMILESCOCCn1c(-c2ccc(F)cc2)cnc1NCc1cccc(OCc2ccccc2)c1
InChIInChI=1S/C26H26FN3O2/c1-31-15-14-30-25(22-10-12-23(27)13-11-22)18-29-26(30)28-17-21-8-5-9-24(16-21)32-19-20-6-3-2-4-7-20/h2-13,16,18H,14-15,17,19H2,1H3,(H,28,29)
InChIKeyZXVAZVILQOWDSX-UHFFFAOYSA-N
XLogP5.53
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500431.51
LogP ≤ 55.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine 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

5-(4-chlorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine
CID 4691572
N-[(3-bromophenyl)methyl]-5-(4-fluorophenyl)-1-(2-methoxyethyl)imidazol-2-amine
CID 5042199
N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-1-methyl-5-(4-methylphenyl)imidazol-2-amine
CID 3657177
N-[(4-fluorophenyl)methyl]-1-methyl-5-phenylimidazol-2-amine
CID 1096454
2-methoxyethyl-[(3-phenylmethoxyphenyl)methyl]azanium
CID 7324179
5-(4-bromophenyl)-N-[(3-methoxyphenyl)methyl]-1-methylimidazol-2-amine;oxalic acid
CID 126460429
5-(3-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]-1-methylimidazol-2-amine;oxalic acid
CID 126468009
1-fluoro-4-[(3-phenylmethoxyphenoxy)methyl]benzene
CID 57107453
5-(4-fluorophenyl)-N-[(4-fluorophenyl)methyl]-1-methylimidazol-2-amine
CID 1096489
4-fluoro-N-[[3-(2-phenoxyethoxy)phenyl]methyl]aniline
CID 54796489
5-(4-bromophenyl)-N-[(3-fluorophenyl)methyl]-1-methylimidazol-2-amine
CID 3605721
5-(3-methoxyphenyl)-1-methyl-N-[(3-phenoxyphenyl)methyl]imidazol-2-amine;oxalic acid
CID 163327777

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine?
The IUPAC name of 5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine (CID 4539990) is 5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine.
What is the SMILES notation for 5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine?
The canonical SMILES for 5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine is COCCn1c(-c2ccc(F)cc2)cnc1NCc1cccc(OCc2ccccc2)c1.
What is the InChIKey of 5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine?
The InChIKey is ZXVAZVILQOWDSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26FN3O2/c1-31-15-14-30-25(22-10-12-23(27)13-11-22)18-29-26(30)28-17-21-8-5-9-24(16-21)32-19-20-6-3-2-4-7-20/h2-13,16,18H,14-15,17,19H2,1H3,(H,28,29).
What are the key properties of 5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine?
5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine has a molecular weight of 431.51 g/mol, XLogP of 5.53, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-1-(2-methoxyethyl)-N-[(3-phenylmethoxyphenyl)methyl]imidazol-2-amine is sourced from PubChem (CID 4539990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).