4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline

C20H17N3O — CID 50981223

IUPAC4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline
SMILESCOc1ccc(Cn2ccnc2-c2ccnc3ccccc23)cc1
InChIInChI=1S/C20H17N3O/c1-24-16-8-6-15(7-9-16)14-23-13-12-22-20(23)18-10-11-21-19-5-3-2-4-17(18)19/h2-13H,14H2,1H3
InChIKeyVNYSDVNVMXTXEH-UHFFFAOYSA-N
MW315.38 g/mol
LogP4.16
Rot. Bonds4

About 4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline

4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline (PubChem CID 50981223) has the molecular formula C20H17N3O and a molecular weight of 315.38 g/mol. Its IUPAC name is 4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline.

Molecular Properties

Compound Name4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline
PubChem CID50981223
Molecular FormulaC20H17N3O
Molecular Weight315.38 g/mol
Exact Mass315.14
IUPAC Name4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline
SMILESCOc1ccc(Cn2ccnc2-c2ccnc3ccccc23)cc1
InChIInChI=1S/C20H17N3O/c1-24-16-8-6-15(7-9-16)14-23-13-12-22-20(23)18-10-11-21-19-5-3-2-4-17(18)19/h2-13H,14H2,1H3
InChIKeyVNYSDVNVMXTXEH-UHFFFAOYSA-N
XLogP4.16
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.38
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,3-difluoro-4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]imidazole
CID 56863534
1-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]-6,11-dihydrobenzo[b]quinolizin-5-ium
CID 19047437
4-[7-(4-methoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]quinoline
CID 53393051
1-(4-methoxyphenyl)-N-(quinolin-4-ylmethyl)methanamine
CID 63850040
N-[2-(4-methoxyphenyl)ethyl]-N-methylquinazolin-4-amine
CID 163348860
4-[1-[2-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl]imidazol-2-yl]quinoline
CID 56861407
2-[(4-methoxyphenyl)methyl]-3-(4-methylphenyl)indazole
CID 11645597
4-[[2-(2-methoxyphenyl)imidazol-1-yl]methyl]benzoic acid
CID 82560557
1-[(2-chlorophenyl)methyl]-2-(5-methoxy-2-phenylphenyl)imidazole
CID 90791888
4-[[2-(2-iodophenyl)imidazol-1-yl]methyl]phenol
CID 82560831
2-[(4-methoxyphenyl)methyl]benzotriazole
CID 3828598
[4-[[2-[(4-methoxyphenyl)methyl]imidazol-1-yl]methyl]phenyl]methanamine
CID 82557940

Frequently Asked Questions

What is the IUPAC name of 4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline?
The IUPAC name of 4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline (CID 50981223) is 4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline.
What is the SMILES notation for 4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline?
The canonical SMILES for 4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline is COc1ccc(Cn2ccnc2-c2ccnc3ccccc23)cc1.
What is the InChIKey of 4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline?
The InChIKey is VNYSDVNVMXTXEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O/c1-24-16-8-6-15(7-9-16)14-23-13-12-22-20(23)18-10-11-21-19-5-3-2-4-17(18)19/h2-13H,14H2,1H3.
What are the key properties of 4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline?
4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline has a molecular weight of 315.38 g/mol, XLogP of 4.16, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]quinoline is sourced from PubChem (CID 50981223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).