2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole

C17H11ClN4O — CID 102507726

IUPAC2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole
SMILESClc1ccccc1-c1ncc(-c2ncc(-c3cccnc3)o2)[nH]1
InChIInChI=1S/C17H11ClN4O/c18-13-6-2-1-5-12(13)16-20-9-14(22-16)17-21-10-15(23-17)11-4-3-7-19-8-11/h1-10H,(H,20,22)
InChIKeyKHSVGTDSWFJDPB-UHFFFAOYSA-N
MW322.76 g/mol
LogP4.45
Rot. Bonds3

About 2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole

2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole (PubChem CID 102507726) has the molecular formula C17H11ClN4O and a molecular weight of 322.76 g/mol. Its IUPAC name is 2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole.

Molecular Properties

Compound Name2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole
PubChem CID102507726
Molecular FormulaC17H11ClN4O
Molecular Weight322.76 g/mol
Exact Mass322.06
IUPAC Name2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole
SMILESClc1ccccc1-c1ncc(-c2ncc(-c3cccnc3)o2)[nH]1
InChIInChI=1S/C17H11ClN4O/c18-13-6-2-1-5-12(13)16-20-9-14(22-16)17-21-10-15(23-17)11-4-3-7-19-8-11/h1-10H,(H,20,22)
InChIKeyKHSVGTDSWFJDPB-UHFFFAOYSA-N
XLogP4.45
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.76
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3,4-dichlorophenyl)-2-pyridin-3-yl-1,3-oxazole
CID 71026476
5-(2-chlorophenyl)-2-(4-methyl-3-pyridinyl)-1,3-oxazole
CID 86217575
3-(2-chlorophenyl)-5-pyridin-3-yl-1,2,4-oxadiazole
CID 2031229
3-[5-(2-methoxyphenyl)-1H-imidazol-2-yl]pyridine
CID 99963134
2-(2-chlorophenyl)-5-(4-methoxyphenyl)-1,3-oxazole
CID 102314201
4-methyl-3-(2-pyridin-3-yl-1H-imidazol-5-yl)pyridine
CID 86217259
N,N-dimethyl-4-(2-pyridin-3-yl-1,3-oxazol-5-yl)aniline
CID 171976930
5-(4-methoxyphenyl)-2-pyridin-3-yl-1,3-oxazole
CID 928446
3-[5-(2,3-dichlorophenyl)-4-phenyl-1H-imidazol-2-yl]pyridine
CID 150000034
3-(2-pyridin-3-yl-1H-imidazol-5-yl)quinoline
CID 141253791
5-phenyl-2-(2-pyridin-2-ylphenyl)-1,3-oxazole
CID 135057630
2-bromo-5-(2-chlorophenyl)-1,3-oxazole
CID 117259589

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole?
The IUPAC name of 2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole (CID 102507726) is 2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole.
What is the SMILES notation for 2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole?
The canonical SMILES for 2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole is Clc1ccccc1-c1ncc(-c2ncc(-c3cccnc3)o2)[nH]1.
What is the InChIKey of 2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole?
The InChIKey is KHSVGTDSWFJDPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11ClN4O/c18-13-6-2-1-5-12(13)16-20-9-14(22-16)17-21-10-15(23-17)11-4-3-7-19-8-11/h1-10H,(H,20,22).
What are the key properties of 2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole?
2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole has a molecular weight of 322.76 g/mol, XLogP of 4.45, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-chlorophenyl)-1H-imidazol-5-yl]-5-pyridin-3-yl-1,3-oxazole is sourced from PubChem (CID 102507726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).