1-(3-chlorophenyl)pyrazole;2-(3,4-difluorophenyl)pyridine;1-(4-fluorophenyl)imidazole;1-(4-fluorophenyl)pyrazole;2-(3-fluorophenyl)-1,3-thiazole;4-(1H-imidazol-5-yl)pyridine;methane;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;4-methyl-1-phenylpyrazole;5-methyl-1-phenylpyrazole;1-phenylimidazole;2-phenylpyrimidine;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine

C151H135ClF5N31O3S — CID 158269922

About 1-(3-chlorophenyl)pyrazole;2-(3,4-difluorophenyl)pyridine;1-(4-fluorophenyl)imidazole;1-(4-fluorophenyl)pyrazole;2-(3-fluorophenyl)-1,3-thiazole;4-(1H-imidazol-5-yl)pyridine;methane;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;4-methyl-1-phenylpyrazole;5-methyl-1-phenylpyrazole;1-phenylimidazole;2-phenylpyrimidine;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine

1-(3-chlorophenyl)pyrazole;2-(3,4-difluorophenyl)pyridine;1-(4-fluorophenyl)imidazole;1-(4-fluorophenyl)pyrazole;2-(3-fluorophenyl)-1,3-thiazole;4-(1H-imidazol-5-yl)pyridine;methane;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;4-methyl-1-phenylpyrazole;5-methyl-1-phenylpyrazole;1-phenylimidazole;2-phenylpyrimidine;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine (PubChem CID 158269922) has the molecular formula C151H135ClF5N31O3S and a molecular weight of 2594.46 g/mol. Its IUPAC name is 1-(3-chlorophenyl)pyrazole;2-(3,4-difluorophenyl)pyridine;1-(4-fluorophenyl)imidazole;1-(4-fluorophenyl)pyrazole;2-(3-fluorophenyl)-1,3-thiazole;4-(1H-imidazol-5-yl)pyridine;methane;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;4-methyl-1-phenylpyrazole;5-methyl-1-phenylpyrazole;1-phenylimidazole;2-phenylpyrimidine;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine.

Molecular Properties

• Compound Name: 1-(3-chlorophenyl)pyrazole;2-(3,4-difluorophenyl)pyridine;1-(4-fluorophenyl)imidazole;1-(4-fluorophenyl)pyrazole;2-(3-fluorophenyl)-1,3-thiazole;4-(1H-imidazol-5-yl)pyridine;methane;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;4-methyl-1-phenylpyrazole;5-methyl-1-phenylpyrazole;1-phenylimidazole;2-phenylpyrimidine;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine
• PubChem CID: 158269922
• Molecular Formula: C151H135ClF5N31O3S
• Molecular Weight: 2594.46 g/mol
• Exact Mass: 2592.07
• IUPAC Name: 1-(3-chlorophenyl)pyrazole;2-(3,4-difluorophenyl)pyridine;1-(4-fluorophenyl)imidazole;1-(4-fluorophenyl)pyrazole;2-(3-fluorophenyl)-1,3-thiazole;4-(1H-imidazol-5-yl)pyridine;methane;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;4-methyl-1-phenylpyrazole;5-methyl-1-phenylpyrazole;1-phenylimidazole;2-phenylpyrimidine;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine
• SMILES: C.C.C1=NC(c2ccccn2)=CC1.COc1cccc(-n2cccn2)c1.Cc1cccc(-n2cccn2)c1.Cc1ccnn1-c1ccccc1.Cc1cnn(-c2ccccc2)c1.Cc1nc(-c2ccccc2)no1.Clc1cccc(-n2cccn2)c1.Fc1ccc(-c2ccccn2)cc1F.Fc1ccc(-n2cccn2)cc1.Fc1ccc(-n2ccnc2)cc1.Fc1cccc(-c2nccs2)c1.c1cc(-c2cnc[nH]2)ccn1.c1ccc(-c2ncccn2)cc1.c1ccc(-n2ccnc2)cc1.c1cncc(-c2ccc[nH]2)c1.c1cncc(-c2ccon2)c1
• InChI: InChI=1S/C11H7F2N.C10H10N2O.3C10H10N2.C10H8N2.C9H7ClN2.2C9H7FN2.C9H6FNS.C9H8N2O.3C9H8N2.C8H7N3.C8H6N2O.2CH4/c12-9-5-4-8(7-10(9)13)11-3-1-2-6-14-11;1-13-10-5-2-4-9(8-10)12-7-3-6-11-12;1-9-4-2-5-10(8-9)12-7-3-6-11-12;1-9-7-11-12(8-9)10-5-3-2-4-6-10;1-9-7-8-11-12(9)10-5-3-2-4-6-10;1-2-5-9(6-3-1)10-11-7-4-8-12-10;10-8-3-1-4-9(7-8)12-6-2-5-11-12;10-8-2-4-9(5-3-8)12-7-1-6-11-12;10-8-1-3-9(4-2-8)12-6-5-11-7-12;10-8-3-1-2-7(6-8)9-11-4-5-12-9;1-7-10-9(11-12-7)8-5-3-2-4-6-8;1-3-8(7-10-5-1)9-4-2-6-11-9;1-2-6-10-8(4-1)9-5-3-7-11-9;1-2-4-9(5-3-1)11-7-6-10-8-11;1-3-9-4-2-7(1)8-5-10-6-11-8;1-2-7(6-9-4-1)8-3-5-11-10-8;;/h1-7H;2-8H,1H3;3*2-8H,1H3;1-8H;3*1-7H;1-6H;2-6H,1H3;1-7,11H;1-2,4-7H,3H2;1-8H;1-6H,(H,10,11);1-6H;2*1H4
• InChIKey: GIXCMPMETKICPU-UHFFFAOYSA-N
• XLogP: 35.46
• TPSA: 376.69 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 33
• Rotatable Bonds: 17
• Heavy Atoms: 192
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2594.46
LogP ≤ 5	35.46
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	33

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)pyrazole;2-(3,4-difluorophenyl)pyridine;1-(4-fluorophenyl)imidazole;1-(4-fluorophenyl)pyrazole;2-(3-fluorophenyl)-1,3-thiazole;4-(1H-imidazol-5-yl)pyridine;methane;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;4-methyl-1-phenylpyrazole;5-methyl-1-phenylpyrazole;1-phenylimidazole;2-phenylpyrimidine;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine?

The IUPAC name of 1-(3-chlorophenyl)pyrazole;2-(3,4-difluorophenyl)pyridine;1-(4-fluorophenyl)imidazole;1-(4-fluorophenyl)pyrazole;2-(3-fluorophenyl)-1,3-thiazole;4-(1H-imidazol-5-yl)pyridine;methane;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;4-methyl-1-phenylpyrazole;5-methyl-1-phenylpyrazole;1-phenylimidazole;2-phenylpyrimidine;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine (CID 158269922) is 1-(3-chlorophenyl)pyrazole;2-(3,4-difluorophenyl)pyridine;1-(4-fluorophenyl)imidazole;1-(4-fluorophenyl)pyrazole;2-(3-fluorophenyl)-1,3-thiazole;4-(1H-imidazol-5-yl)pyridine;methane;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;4-methyl-1-phenylpyrazole;5-methyl-1-phenylpyrazole;1-phenylimidazole;2-phenylpyrimidine;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine.

What is the SMILES notation for 1-(3-chlorophenyl)pyrazole;2-(3,4-difluorophenyl)pyridine;1-(4-fluorophenyl)imidazole;1-(4-fluorophenyl)pyrazole;2-(3-fluorophenyl)-1,3-thiazole;4-(1H-imidazol-5-yl)pyridine;methane;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;4-methyl-1-phenylpyrazole;5-methyl-1-phenylpyrazole;1-phenylimidazole;2-phenylpyrimidine;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine?

The canonical SMILES for 1-(3-chlorophenyl)pyrazole;2-(3,4-difluorophenyl)pyridine;1-(4-fluorophenyl)imidazole;1-(4-fluorophenyl)pyrazole;2-(3-fluorophenyl)-1,3-thiazole;4-(1H-imidazol-5-yl)pyridine;methane;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;4-methyl-1-phenylpyrazole;5-methyl-1-phenylpyrazole;1-phenylimidazole;2-phenylpyrimidine;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine is C.C.C1=NC(c2ccccn2)=CC1.COc1cccc(-n2cccn2)c1.Cc1cccc(-n2cccn2)c1.Cc1ccnn1-c1ccccc1.Cc1cnn(-c2ccccc2)c1.Cc1nc(-c2ccccc2)no1.Clc1cccc(-n2cccn2)c1.Fc1ccc(-c2ccccn2)cc1F.Fc1ccc(-n2cccn2)cc1.Fc1ccc(-n2ccnc2)cc1.Fc1cccc(-c2nccs2)c1.c1cc(-c2cnc[nH]2)ccn1.c1ccc(-c2ncccn2)cc1.c1ccc(-n2ccnc2)cc1.c1cncc(-c2ccc[nH]2)c1.c1cncc(-c2ccon2)c1.

What is the InChIKey of 1-(3-chlorophenyl)pyrazole;2-(3,4-difluorophenyl)pyridine;1-(4-fluorophenyl)imidazole;1-(4-fluorophenyl)pyrazole;2-(3-fluorophenyl)-1,3-thiazole;4-(1H-imidazol-5-yl)pyridine;methane;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;4-methyl-1-phenylpyrazole;5-methyl-1-phenylpyrazole;1-phenylimidazole;2-phenylpyrimidine;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine?

The InChIKey is GIXCMPMETKICPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7F2N.C10H10N2O.3C10H10N2.C10H8N2.C9H7ClN2.2C9H7FN2.C9H6FNS.C9H8N2O.3C9H8N2.C8H7N3.C8H6N2O.2CH4/c12-9-5-4-8(7-10(9)13)11-3-1-2-6-14-11;1-13-10-5-2-4-9(8-10)12-7-3-6-11-12;1-9-4-2-5-10(8-9)12-7-3-6-11-12;1-9-7-11-12(8-9)10-5-3-2-4-6-10;1-9-7-8-11-12(9)10-5-3-2-4-6-10;1-2-5-9(6-3-1)10-11-7-4-8-12-10;10-8-3-1-4-9(7-8)12-6-2-5-11-12;10-8-2-4-9(5-3-8)12-7-1-6-11-12;10-8-1-3-9(4-2-8)12-6-5-11-7-12;10-8-3-1-2-7(6-8)9-11-4-5-12-9;1-7-10-9(11-12-7)8-5-3-2-4-6-8;1-3-8(7-10-5-1)9-4-2-6-11-9;1-2-6-10-8(4-1)9-5-3-7-11-9;1-2-4-9(5-3-1)11-7-6-10-8-11;1-3-9-4-2-7(1)8-5-10-6-11-8;1-2-7(6-9-4-1)8-3-5-11-10-8;;/h1-7H;2-8H,1H3;3*2-8H,1H3;1-8H;3*1-7H;1-6H;2-6H,1H3;1-7,11H;1-2,4-7H,3H2;1-8H;1-6H,(H,10,11);1-6H;2*1H4.

What are the key properties of 1-(3-chlorophenyl)pyrazole;2-(3,4-difluorophenyl)pyridine;1-(4-fluorophenyl)imidazole;1-(4-fluorophenyl)pyrazole;2-(3-fluorophenyl)-1,3-thiazole;4-(1H-imidazol-5-yl)pyridine;methane;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;4-methyl-1-phenylpyrazole;5-methyl-1-phenylpyrazole;1-phenylimidazole;2-phenylpyrimidine;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine?

1-(3-chlorophenyl)pyrazole;2-(3,4-difluorophenyl)pyridine;1-(4-fluorophenyl)imidazole;1-(4-fluorophenyl)pyrazole;2-(3-fluorophenyl)-1,3-thiazole;4-(1H-imidazol-5-yl)pyridine;methane;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;4-methyl-1-phenylpyrazole;5-methyl-1-phenylpyrazole;1-phenylimidazole;2-phenylpyrimidine;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine has a molecular weight of 2594.46 g/mol, XLogP of 35.46, 17 rotatable bonds, 2 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(3-chlorophenyl)pyrazole;2-(3,4-difluorophenyl)pyridine;1-(4-fluorophenyl)imidazole;1-(4-fluorophenyl)pyrazole;2-(3-fluorophenyl)-1,3-thiazole;4-(1H-imidazol-5-yl)pyridine;methane;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;4-methyl-1-phenylpyrazole;5-methyl-1-phenylpyrazole;1-phenylimidazole;2-phenylpyrimidine;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine is sourced from PubChem (CID 158269922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).