4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine

C22H17N5O — CID 50974400

IUPAC4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine
SMILESc1ccc(-c2ncn(Cc3ccncc3)c2-c2ccc(-c3ccn[nH]3)o2)cc1
InChIInChI=1S/C22H17N5O/c1-2-4-17(5-3-1)21-22(20-7-6-19(28-20)18-10-13-25-26-18)27(15-24-21)14-16-8-11-23-12-9-16/h1-13,15H,14H2,(H,25,26)
InChIKeyDOAQUTWCCSZQQD-UHFFFAOYSA-N
MW367.41 g/mol
LogP4.64
Rot. Bonds5

About 4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine

4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine (PubChem CID 50974400) has the molecular formula C22H17N5O and a molecular weight of 367.41 g/mol. Its IUPAC name is 4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine.

Molecular Properties

Compound Name4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine
PubChem CID50974400
Molecular FormulaC22H17N5O
Molecular Weight367.41 g/mol
Exact Mass367.14
IUPAC Name4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine
SMILESc1ccc(-c2ncn(Cc3ccncc3)c2-c2ccc(-c3ccn[nH]3)o2)cc1
InChIInChI=1S/C22H17N5O/c1-2-4-17(5-3-1)21-22(20-7-6-19(28-20)18-10-13-25-26-18)27(15-24-21)14-16-8-11-23-12-9-16/h1-13,15H,14H2,(H,25,26)
InChIKeyDOAQUTWCCSZQQD-UHFFFAOYSA-N
XLogP4.64
TPSA72.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-5-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyrazine
CID 50952225
4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine
CID 50963775
1-[[2-[(4,5-diphenylimidazol-1-yl)methyl]phenyl]methyl]-4,5-diphenylimidazole
CID 15794352
3-benzyl-6-(1H-pyrazol-5-yl)quinazolin-4-one
CID 155594064
5-(5-phenylmethoxyfuran-2-yl)-1H-pyrazole
CID 57277237
2-(4-phenyl-5-pyridin-4-ylimidazol-1-yl)acetic acid
CID 70723096
1-[(1-ethylimidazol-2-yl)methyl]-4-phenyl-5-(5-pyrazolidin-3-ylfuran-2-yl)imidazole
CID 75594107
[5-[3-(1H-indol-4-ylmethyl)-5-phenylimidazol-4-yl]furan-2-yl]methanol
CID 50962501
4-[3-[2-(1H-imidazol-5-yl)ethyl]-5-phenylimidazol-4-yl]pyridine
CID 50957636
3-[3-[(4-fluorophenyl)methyl]-5-phenylimidazol-4-yl]pyrazolo[1,5-a]pyrimidine
CID 50975114
4-[(2-phenylimidazol-1-yl)methyl]pyridine
CID 67150298
4-[3-[2-(4-methyltriazol-1-yl)ethyl]-5-phenylimidazol-4-yl]pyridine
CID 50985644

Frequently Asked Questions

What is the IUPAC name of 4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine?
The IUPAC name of 4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine (CID 50974400) is 4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine.
What is the SMILES notation for 4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine?
The canonical SMILES for 4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine is c1ccc(-c2ncn(Cc3ccncc3)c2-c2ccc(-c3ccn[nH]3)o2)cc1.
What is the InChIKey of 4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine?
The InChIKey is DOAQUTWCCSZQQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N5O/c1-2-4-17(5-3-1)21-22(20-7-6-19(28-20)18-10-13-25-26-18)27(15-24-21)14-16-8-11-23-12-9-16/h1-13,15H,14H2,(H,25,26).
What are the key properties of 4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine?
4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine has a molecular weight of 367.41 g/mol, XLogP of 4.64, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-phenyl-5-[5-(1H-pyrazol-5-yl)furan-2-yl]imidazol-1-yl]methyl]pyridine is sourced from PubChem (CID 50974400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).