4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole

C126H152F2N16O2 — CID 159753454

IUPAC4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole
SMILESCC(C)c1ccc(-c2cncn2C)cc1F.Cc1c(-c2ccc(C(C)C)c(F)c2)cnn1C.Cc1cc(-c2cccnc2)ccc1C(C)C.Cc1cc(-c2cnn(C)c2)ccc1C(C)C.Cc1cc(-n2ccnn2)ccc1C(C)C.Cc1ccncc1-c1ccc(C(C)C)c(C)c1.Cc1cncc(-c2ccc(C(C)C)c(C)c2)c1.Cc1noc(-c2ccc(C(C)C)c(C)c2)n1.Cc1noc(-c2ccc(C(C)C)c(C)c2)n1
InChIInChI=1S/2C16H19N.C15H17N.C14H17FN2.C14H18N2.C13H15FN2.2C13H16N2O.C12H15N3/c1-11(2)16-6-5-14(8-13(16)4)15-7-12(3)9-17-10-15;1-11(2)15-6-5-14(9-13(15)4)16-10-17-8-7-12(16)3;1-11(2)15-7-6-13(9-12(15)3)14-5-4-8-16-10-14;1-9(2)12-6-5-11(7-14(12)15)13-8-16-17(4)10(13)3;1-10(2)14-6-5-12(7-11(14)3)13-8-15-16(4)9-13;1-9(2)11-5-4-10(6-12(11)14)13-7-15-8-16(13)3;2*1-8(2)12-6-5-11(7-9(12)3)13-14-10(4)15-16-13;1-9(2)12-5-4-11(8-10(12)3)15-7-6-13-14-15/h2*5-11H,1-4H3;4-11H,1-3H3;5-9H,1-4H3;5-10H,1-4H3;4-9H,1-3H3;2*5-8H,1-4H3;4-9H,1-3H3
InChIKeyNDYJKQGOVGTNCM-UHFFFAOYSA-N
MW1960.71 g/mol
LogP33.34
Rot. Bonds18

About 4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole

4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole (PubChem CID 159753454) has the molecular formula C126H152F2N16O2 and a molecular weight of 1960.71 g/mol. Its IUPAC name is 4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole.

Molecular Properties

Compound Name4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole
PubChem CID159753454
Molecular FormulaC126H152F2N16O2
Molecular Weight1960.71 g/mol
Exact Mass1959.23
IUPAC Name4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole
SMILESCC(C)c1ccc(-c2cncn2C)cc1F.Cc1c(-c2ccc(C(C)C)c(F)c2)cnn1C.Cc1cc(-c2cccnc2)ccc1C(C)C.Cc1cc(-c2cnn(C)c2)ccc1C(C)C.Cc1cc(-n2ccnn2)ccc1C(C)C.Cc1ccncc1-c1ccc(C(C)C)c(C)c1.Cc1cncc(-c2ccc(C(C)C)c(C)c2)c1.Cc1noc(-c2ccc(C(C)C)c(C)c2)n1.Cc1noc(-c2ccc(C(C)C)c(C)c2)n1
InChIInChI=1S/2C16H19N.C15H17N.C14H17FN2.C14H18N2.C13H15FN2.2C13H16N2O.C12H15N3/c1-11(2)16-6-5-14(8-13(16)4)15-7-12(3)9-17-10-15;1-11(2)15-6-5-14(9-13(15)4)16-10-17-8-7-12(16)3;1-11(2)15-7-6-13(9-12(15)3)14-5-4-8-16-10-14;1-9(2)12-6-5-11(7-14(12)15)13-8-16-17(4)10(13)3;1-10(2)14-6-5-12(7-11(14)3)13-8-15-16(4)9-13;1-9(2)11-5-4-10(6-12(11)14)13-7-15-8-16(13)3;2*1-8(2)12-6-5-11(7-9(12)3)13-14-10(4)15-16-13;1-9(2)12-5-4-11(8-10(12)3)15-7-6-13-14-15/h2*5-11H,1-4H3;4-11H,1-3H3;5-9H,1-4H3;5-10H,1-4H3;4-9H,1-3H3;2*5-8H,1-4H3;4-9H,1-3H3
InChIKeyNDYJKQGOVGTNCM-UHFFFAOYSA-N
XLogP33.34
TPSA200.68 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds18
Heavy Atoms146
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001960.71
LogP ≤ 533.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole with MolForge

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Related Compounds

1,5-dimethyl-4-(4-propan-2-ylphenyl)pyrazole;2-(1,5-dimethylpyrazol-4-yl)-5-propan-2-ylpyridine;2-(3-methylimidazol-4-yl)-5-propan-2-ylpyridine;1-methyl-5-(4-propan-2-ylphenyl)imidazole;bis(3-methyl-5-(4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(4-propan-2-ylphenyl)pyrazole;3-methyl-5-(4-propan-2-ylphenyl)pyridine;4-methyl-3-(4-propan-2-ylphenyl)pyridine;bis(3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2,4-oxadiazole);3-methyl-5-(6-propan-2-yl-3-pyridinyl)pyridine;2-(1-methylpyrazol-4-yl)-5-propan-2-ylpyridine;2-(4-methyl-3-pyridinyl)-5-propan-2-ylpyridine;2-(5-methyl-3-pyridinyl)-5-propan-2-ylpyridine;3-(4-propan-2-ylphenyl)pyridine;1-(4-propan-2-ylphenyl)triazole;2-propan-2-yl-5-pyridin-3-ylpyridine;5-propan-2-yl-2-pyridin-3-ylpyridine;5-propan-2-yl-2-(triazol-1-yl)pyridine
CID 159206096
5-(3,4-dimethylphenyl)-3-(3-methyl-4-pyridinyl)-1,2,4-oxadiazole;5-(3,4-dimethylphenyl)-3-(5-methyl-3-pyridinyl)-1,2,4-oxadiazole;bis(5-(3,4-dimethylphenyl)-3-pyridin-3-yl-1,2,4-oxadiazole)
CID 159673647
3-methyl-5-[4-[10-(3-pyridin-3-ylphenyl)anthracen-9-yl]phenyl]pyridine;3-methyl-5-[4-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]pyridine;4-methyl-3-[4-[10-(3-pyridin-4-ylphenyl)anthracen-9-yl]phenyl]pyridine
CID 157188872
3-(1-methylpyrazol-4-yl)pyridine;dihydrochloride
CID 119106449
4-(3-fluoro-4-methylphenyl)-1,5-dimethylpyrazole
CID 121385904
4-methyl-3-[6-[5-[5-(triazol-1-yl)-2-pyridinyl]hexan-2-yl]-3-pyridinyl]pyridine
CID 135279927
3-(4-fluoro-3-propan-2-ylphenyl)pyridine
CID 83381583
6-(1,5-dimethylpyrazol-4-yl)-3-pyridin-3-yl-9H-pyrido[3,4-b]indole
CID 123980413
3-methyl-5-(5-pyridin-3-yl-3-pyridinyl)pyridine
CID 170233955
7-(1-methylpyrazol-4-yl)isoquinoline
CID 134091205
N-[[4-(1,5-dimethylpyrazol-4-yl)-2-fluorophenyl]methyl]propan-2-amine
CID 66097006
6-[6-fluoro-2-(3-methylimidazol-4-yl)-5-(1-methylpyrazol-4-yl)benzimidazol-1-yl]-1,3-dimethyl-4-propan-2-ylbenzimidazol-2-one
CID 177184658

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole?
The IUPAC name of 4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole (CID 159753454) is 4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole.
What is the SMILES notation for 4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole?
The canonical SMILES for 4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole is CC(C)c1ccc(-c2cncn2C)cc1F.Cc1c(-c2ccc(C(C)C)c(F)c2)cnn1C.Cc1cc(-c2cccnc2)ccc1C(C)C.Cc1cc(-c2cnn(C)c2)ccc1C(C)C.Cc1cc(-n2ccnn2)ccc1C(C)C.Cc1ccncc1-c1ccc(C(C)C)c(C)c1.Cc1cncc(-c2ccc(C(C)C)c(C)c2)c1.Cc1noc(-c2ccc(C(C)C)c(C)c2)n1.Cc1noc(-c2ccc(C(C)C)c(C)c2)n1.
What is the InChIKey of 4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole?
The InChIKey is NDYJKQGOVGTNCM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C16H19N.C15H17N.C14H17FN2.C14H18N2.C13H15FN2.2C13H16N2O.C12H15N3/c1-11(2)16-6-5-14(8-13(16)4)15-7-12(3)9-17-10-15;1-11(2)15-6-5-14(9-13(15)4)16-10-17-8-7-12(16)3;1-11(2)15-7-6-13(9-12(15)3)14-5-4-8-16-10-14;1-9(2)12-6-5-11(7-14(12)15)13-8-16-17(4)10(13)3;1-10(2)14-6-5-12(7-11(14)3)13-8-15-16(4)9-13;1-9(2)11-5-4-10(6-12(11)14)13-7-15-8-16(13)3;2*1-8(2)12-6-5-11(7-9(12)3)13-14-10(4)15-16-13;1-9(2)12-5-4-11(8-10(12)3)15-7-6-13-14-15/h2*5-11H,1-4H3;4-11H,1-3H3;5-9H,1-4H3;5-10H,1-4H3;4-9H,1-3H3;2*5-8H,1-4H3;4-9H,1-3H3.
What are the key properties of 4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole?
4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole has a molecular weight of 1960.71 g/mol, XLogP of 33.34, 18 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluoro-4-propan-2-ylphenyl)-1,5-dimethylpyrazole;5-(3-fluoro-4-propan-2-ylphenyl)-1-methylimidazole;bis(3-methyl-5-(3-methyl-4-propan-2-ylphenyl)-1,2,4-oxadiazole);1-methyl-4-(3-methyl-4-propan-2-ylphenyl)pyrazole;3-methyl-5-(3-methyl-4-propan-2-ylphenyl)pyridine;4-methyl-3-(3-methyl-4-propan-2-ylphenyl)pyridine;3-(3-methyl-4-propan-2-ylphenyl)pyridine;1-(3-methyl-4-propan-2-ylphenyl)triazole is sourced from PubChem (CID 159753454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).