[4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol

C141H164FN9O8 — CID 157209645

IUPAC[4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol
SMILESCC(C)c1ccc(-c2cccnc2CO)cc1.COc1cc(C(C)C)ccc1-c1ccccc1CO.COc1cc(C(C)C)ccc1-c1cnc(C)nc1CO.COc1cc(C(C)C)ccc1-c1cnccc1C.COc1nc(C)ncc1-c1ccc(C(C)C)cc1.Cc1cc(-c2ccc(C(C)C)cc2F)c(CO)nn1.Cc1ccc(-c2ccc(C(C)C)cc2)cc1.Cc1cccc(-c2ccc(C(C)C)cc2)c1.Cc1ccncc1-c1ccc(C(C)C)cc1
InChIInChI=1S/C17H20O2.C16H20N2O2.C16H19NO.2C16H18.C15H17FN2O.C15H18N2O.C15H17NO.C15H17N/c1-12(2)13-8-9-16(17(10-13)19-3)15-7-5-4-6-14(15)11-18;1-10(2)12-5-6-13(16(7-12)20-4)14-8-17-11(3)18-15(14)9-19;1-11(2)13-5-6-14(16(9-13)18-4)15-10-17-8-7-12(15)3;1-12(2)14-8-10-16(11-9-14)15-6-4-13(3)5-7-15;1-12(2)14-7-9-15(10-8-14)16-6-4-5-13(3)11-16;1-9(2)11-4-5-12(14(16)7-11)13-6-10(3)17-18-15(13)8-19;1-10(2)12-5-7-13(8-6-12)14-9-16-11(3)17-15(14)18-4;1-11(2)12-5-7-13(8-6-12)14-4-3-9-16-15(14)10-17;1-11(2)13-4-6-14(7-5-13)15-10-16-9-8-12(15)3/h4-10,12,18H,11H2,1-3H3;5-8,10,19H,9H2,1-4H3;5-11H,1-4H3;2*4-12H,1-3H3;4-7,9,19H,8H2,1-3H3;5-10H,1-4H3;3-9,11,17H,10H2,1-2H3;4-11H,1-3H3
InChIKeyARTAAYINGXRIBT-UHFFFAOYSA-N
MW2131.92 g/mol
LogP35.15
Rot. Bonds26

About [4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol

[4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol (PubChem CID 157209645) has the molecular formula C141H164FN9O8 and a molecular weight of 2131.92 g/mol. Its IUPAC name is [4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol
PubChem CID157209645
Molecular FormulaC141H164FN9O8
Molecular Weight2131.92 g/mol
Exact Mass2130.27
IUPAC Name[4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol
SMILESCC(C)c1ccc(-c2cccnc2CO)cc1.COc1cc(C(C)C)ccc1-c1ccccc1CO.COc1cc(C(C)C)ccc1-c1cnc(C)nc1CO.COc1cc(C(C)C)ccc1-c1cnccc1C.COc1nc(C)ncc1-c1ccc(C(C)C)cc1.Cc1cc(-c2ccc(C(C)C)cc2F)c(CO)nn1.Cc1ccc(-c2ccc(C(C)C)cc2)cc1.Cc1cccc(-c2ccc(C(C)C)cc2)c1.Cc1ccncc1-c1ccc(C(C)C)cc1
InChIInChI=1S/C17H20O2.C16H20N2O2.C16H19NO.2C16H18.C15H17FN2O.C15H18N2O.C15H17NO.C15H17N/c1-12(2)13-8-9-16(17(10-13)19-3)15-7-5-4-6-14(15)11-18;1-10(2)12-5-6-13(16(7-12)20-4)14-8-17-11(3)18-15(14)9-19;1-11(2)13-5-6-14(16(9-13)18-4)15-10-17-8-7-12(15)3;1-12(2)14-8-10-16(11-9-14)15-6-4-13(3)5-7-15;1-12(2)14-7-9-15(10-8-14)16-6-4-5-13(3)11-16;1-9(2)11-4-5-12(14(16)7-11)13-6-10(3)17-18-15(13)8-19;1-10(2)12-5-7-13(8-6-12)14-9-16-11(3)17-15(14)18-4;1-11(2)12-5-7-13(8-6-12)14-4-3-9-16-15(14)10-17;1-11(2)13-4-6-14(7-5-13)15-10-16-9-8-12(15)3/h4-10,12,18H,11H2,1-3H3;5-8,10,19H,9H2,1-4H3;5-11H,1-4H3;2*4-12H,1-3H3;4-7,9,19H,8H2,1-3H3;5-10H,1-4H3;3-9,11,17H,10H2,1-2H3;4-11H,1-3H3
InChIKeyARTAAYINGXRIBT-UHFFFAOYSA-N
XLogP35.15
TPSA233.85 Ų
H-Bond Donors4
H-Bond Acceptors17
Rotatable Bonds26
Heavy Atoms159
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002131.92
LogP ≤ 535.15
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1017

Analyze [4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol with MolForge

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Launch Full Analysis

Related Compounds

1-[3-fluoro-4-[3-(hydroxymethyl)-6-methylpyridazin-4-yl]phenyl]ethanone;1-[4-[4-(hydroxymethyl)-2-methylpyrimidin-5-yl]-3-methoxyphenyl]ethanone;1-[4-[2-(hydroxymethyl)phenyl]-3-methoxyphenyl]ethanone;1-[4-[2-(hydroxymethyl)-3-pyridinyl]phenyl]ethanone;1-[3-methoxy-4-(4-methyl-3-pyridinyl)phenyl]ethanone;1-[4-(4-methoxy-2-methylpyrimidin-5-yl)phenyl]ethanone;1-(5-methoxy-6-phenyl-3-pyridinyl)ethanone;1-[4-(3-methylphenyl)phenyl]ethanone;1-[4-(4-methylphenyl)phenyl]ethanone;1-[4-(4-methyl-3-pyridinyl)phenyl]ethanone
CID 161453846
4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine
CID 157209646
1-isocyano-4-methoxy-5-methyl-2-(4-propan-2-ylphenyl)benzene;[6-methoxy-5-(4-propan-2-ylphenyl)pyrimidin-4-yl]methanol;bis([5-methyl-2-(4-propan-2-ylphenyl)phenyl]methanol);[2-(4-propan-2-ylphenyl)phenyl]methanol
CID 159879001
2-methyl-3-[4-[10-[4-(3-methyl-4-pyridinyl)naphthalen-1-yl]anthracen-9-yl]phenyl]pyridine;2-methyl-3-[4-[10-[4-(5-methyl-3-pyridinyl)naphthalen-1-yl]anthracen-9-yl]phenyl]pyridine;2-methyl-3-[4-[10-[4-(6-methyl-3-pyridinyl)naphthalen-1-yl]anthracen-9-yl]phenyl]pyridine;2-methyl-5-[4-[10-[4-(4-methyl-3-pyridinyl)naphthalen-1-yl]anthracen-9-yl]phenyl]pyridine;2-methyl-5-[4-[10-[4-(5-methyl-3-pyridinyl)naphthalen-1-yl]anthracen-9-yl]phenyl]pyridine;2-methyl-5-[4-[10-(4-pyridin-3-ylnaphthalen-1-yl)anthracen-9-yl]phenyl]pyridine
CID 161316240
[3-(3-methylphenyl)-4-pyridinyl]methanol
CID 130118995
4-methoxy-6-propan-2-ylazulene
CID 56627743
1-methoxy-2-propan-2-ylbenzene;1-methoxy-4-propan-2-ylbenzene;1-methyl-2-propan-2-ylbenzene;1-methyl-4-propan-2-ylbenzene;4-(3-propan-2-ylphenyl)pyridine
CID 158741701
ethane;3-(2-methylphenyl)pyridine;bis(3-(4-methylphenyl)pyridine);4-(2-methylphenyl)pyridine;4-(3-methylphenyl)pyridine;4-(4-methylphenyl)pyridine
CID 159010834
1-isocyano-4-methoxy-5-methyl-2-(4-propan-2-ylphenyl)benzene;[6-methoxy-5-(4-propan-2-ylphenyl)pyrimidin-4-yl]methanol;bis([5-methyl-2-(4-propan-2-ylphenyl)phenyl]methanol);[5-methyl-2-(5-propan-2-yl-2-pyridinyl)phenyl]methanol;[2-(4-propan-2-ylphenyl)phenyl]methanol
CID 160873961
1,5-dimethylnaphthalene;2,6-dimethylnaphthalene;(4-methoxy-2,5-dimethylphenyl)methanol;1-methyl-2-(4-methylphenyl)benzene;1-methyl-3-(4-methylphenyl)benzene;1-methyl-4-(4-methylphenyl)benzene;1,4-xylene
CID 158455237
4-chloro-3-(4-methoxy-3-methylphenyl)pyridine;2-(4-methoxy-3-methylphenyl)-5-methylpyridine;3-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)-4-methylpyridine;5-(4-methoxy-3-methylphenyl)-2-methylpyridine;3-(4-methoxy-3-methylphenyl)pyridine
CID 162096681
[3-(3,4-dimethoxyphenyl)-2-pyridinyl]methanol
CID 54504327

Frequently Asked Questions

What is the IUPAC name of [4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol?
The IUPAC name of [4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol (CID 157209645) is [4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol.
What is the SMILES notation for [4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol?
The canonical SMILES for [4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol is CC(C)c1ccc(-c2cccnc2CO)cc1.COc1cc(C(C)C)ccc1-c1ccccc1CO.COc1cc(C(C)C)ccc1-c1cnc(C)nc1CO.COc1cc(C(C)C)ccc1-c1cnccc1C.COc1nc(C)ncc1-c1ccc(C(C)C)cc1.Cc1cc(-c2ccc(C(C)C)cc2F)c(CO)nn1.Cc1ccc(-c2ccc(C(C)C)cc2)cc1.Cc1cccc(-c2ccc(C(C)C)cc2)c1.Cc1ccncc1-c1ccc(C(C)C)cc1.
What is the InChIKey of [4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol?
The InChIKey is ARTAAYINGXRIBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O2.C16H20N2O2.C16H19NO.2C16H18.C15H17FN2O.C15H18N2O.C15H17NO.C15H17N/c1-12(2)13-8-9-16(17(10-13)19-3)15-7-5-4-6-14(15)11-18;1-10(2)12-5-6-13(16(7-12)20-4)14-8-17-11(3)18-15(14)9-19;1-11(2)13-5-6-14(16(9-13)18-4)15-10-17-8-7-12(15)3;1-12(2)14-8-10-16(11-9-14)15-6-4-13(3)5-7-15;1-12(2)14-7-9-15(10-8-14)16-6-4-5-13(3)11-16;1-9(2)11-4-5-12(14(16)7-11)13-6-10(3)17-18-15(13)8-19;1-10(2)12-5-7-13(8-6-12)14-9-16-11(3)17-15(14)18-4;1-11(2)12-5-7-13(8-6-12)14-4-3-9-16-15(14)10-17;1-11(2)13-4-6-14(7-5-13)15-10-16-9-8-12(15)3/h4-10,12,18H,11H2,1-3H3;5-8,10,19H,9H2,1-4H3;5-11H,1-4H3;2*4-12H,1-3H3;4-7,9,19H,8H2,1-3H3;5-10H,1-4H3;3-9,11,17H,10H2,1-2H3;4-11H,1-3H3.
What are the key properties of [4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol?
[4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol has a molecular weight of 2131.92 g/mol, XLogP of 35.15, 26 rotatable bonds, 4 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-fluoro-4-propan-2-ylphenyl)-6-methylpyridazin-3-yl]methanol;4-methoxy-2-methyl-5-(4-propan-2-ylphenyl)pyrimidine;3-(2-methoxy-4-propan-2-ylphenyl)-4-methylpyridine;[5-(2-methoxy-4-propan-2-ylphenyl)-2-methylpyrimidin-4-yl]methanol;[2-(2-methoxy-4-propan-2-ylphenyl)phenyl]methanol;1-methyl-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-(4-propan-2-ylphenyl)benzene;4-methyl-3-(4-propan-2-ylphenyl)pyridine;[3-(4-propan-2-ylphenyl)-2-pyridinyl]methanol is sourced from PubChem (CID 157209645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).