6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine

C139H152Cl3N5O5S — CID 161084337

IUPAC6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine
SMILESCC(C)CC(=O)c1ccc(-c2ccccc2)cc1.CC(C)Cc1ccc(C(C)C)cc1.CC(C)c1ccc(-c2cn3ccccc3n2)cc1.CC(C)c1ccc(C(=O)c2ccccc2)s1.CC(C)c1ccc2c(c1)[nH]c1ccc(Cl)cc12.CC(C)c1ccc2cc(CO)ccc2c1.CC(C)c1cccc(Oc2ccccc2)c1.CC(C)c1ccccc1Nc1c(Cl)cccc1Cl.CCC.CCc1nc(-c2ccccc2)c(-c2ccccc2)o1
InChIInChI=1S/C17H15NO.C17H18O.C16H16N2.C15H15Cl2N.C15H14ClN.C15H16O.C14H14OS.C14H16O.C13H20.C3H8/c1-2-15-18-16(13-9-5-3-6-10-13)17(19-15)14-11-7-4-8-12-14;1-13(2)12-17(18)16-10-8-15(9-11-16)14-6-4-3-5-7-14;1-12(2)13-6-8-14(9-7-13)15-11-18-10-4-3-5-16(18)17-15;1-10(2)11-6-3-4-9-14(11)18-15-12(16)7-5-8-13(15)17;1-9(2)10-3-5-12-13-8-11(16)4-6-14(13)17-15(12)7-10;1-12(2)13-7-6-10-15(11-13)16-14-8-4-3-5-9-14;1-10(2)12-8-9-13(16-12)14(15)11-6-4-3-5-7-11;1-10(2)12-5-6-13-7-11(9-15)3-4-14(13)8-12;1-10(2)9-12-5-7-13(8-6-12)11(3)4;1-3-2/h3-12H,2H2,1H3;3-11,13H,12H2,1-2H3;3-12H,1-2H3;3-10,18H,1-2H3;3-9,17H,1-2H3;3-12H,1-2H3;3-10H,1-2H3;3-8,10,15H,9H2,1-2H3;5-8,10-11H,9H2,1-4H3;3H2,1-2H3
InChIKeyUGHRJUIPACWKGE-UHFFFAOYSA-N
MW2111.20 g/mol
LogP41.82
Rot. Bonds24

About 6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine

6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine (PubChem CID 161084337) has the molecular formula C139H152Cl3N5O5S and a molecular weight of 2111.20 g/mol. Its IUPAC name is 6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine
PubChem CID161084337
Molecular FormulaC139H152Cl3N5O5S
Molecular Weight2111.20 g/mol
Exact Mass2108.06
IUPAC Name6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine
SMILESCC(C)CC(=O)c1ccc(-c2ccccc2)cc1.CC(C)Cc1ccc(C(C)C)cc1.CC(C)c1ccc(-c2cn3ccccc3n2)cc1.CC(C)c1ccc(C(=O)c2ccccc2)s1.CC(C)c1ccc2c(c1)[nH]c1ccc(Cl)cc12.CC(C)c1ccc2cc(CO)ccc2c1.CC(C)c1cccc(Oc2ccccc2)c1.CC(C)c1ccccc1Nc1c(Cl)cccc1Cl.CCC.CCc1nc(-c2ccccc2)c(-c2ccccc2)o1
InChIInChI=1S/C17H15NO.C17H18O.C16H16N2.C15H15Cl2N.C15H14ClN.C15H16O.C14H14OS.C14H16O.C13H20.C3H8/c1-2-15-18-16(13-9-5-3-6-10-13)17(19-15)14-11-7-4-8-12-14;1-13(2)12-17(18)16-10-8-15(9-11-16)14-6-4-3-5-7-14;1-12(2)13-6-8-14(9-7-13)15-11-18-10-4-3-5-16(18)17-15;1-10(2)11-6-3-4-9-14(11)18-15-12(16)7-5-8-13(15)17;1-9(2)10-3-5-12-13-8-11(16)4-6-14(13)17-15(12)7-10;1-12(2)13-7-6-10-15(11-13)16-14-8-4-3-5-9-14;1-10(2)12-8-9-13(16-12)14(15)11-6-4-3-5-7-11;1-10(2)12-5-6-13-7-11(9-15)3-4-14(13)8-12;1-10(2)9-12-5-7-13(8-6-12)11(3)4;1-3-2/h3-12H,2H2,1H3;3-11,13H,12H2,1-2H3;3-12H,1-2H3;3-10,18H,1-2H3;3-9,17H,1-2H3;3-12H,1-2H3;3-10H,1-2H3;3-8,10,15H,9H2,1-2H3;5-8,10-11H,9H2,1-4H3;3H2,1-2H3
InChIKeyUGHRJUIPACWKGE-UHFFFAOYSA-N
XLogP41.82
TPSA134.75 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds24
Heavy Atoms153
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002111.20
LogP ≤ 541.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

Analyze 6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine?
The IUPAC name of 6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine (CID 161084337) is 6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine is CC(C)CC(=O)c1ccc(-c2ccccc2)cc1.CC(C)Cc1ccc(C(C)C)cc1.CC(C)c1ccc(-c2cn3ccccc3n2)cc1.CC(C)c1ccc(C(=O)c2ccccc2)s1.CC(C)c1ccc2c(c1)[nH]c1ccc(Cl)cc12.CC(C)c1ccc2cc(CO)ccc2c1.CC(C)c1cccc(Oc2ccccc2)c1.CC(C)c1ccccc1Nc1c(Cl)cccc1Cl.CCC.CCc1nc(-c2ccccc2)c(-c2ccccc2)o1.
What is the InChIKey of 6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine?
The InChIKey is UGHRJUIPACWKGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO.C17H18O.C16H16N2.C15H15Cl2N.C15H14ClN.C15H16O.C14H14OS.C14H16O.C13H20.C3H8/c1-2-15-18-16(13-9-5-3-6-10-13)17(19-15)14-11-7-4-8-12-14;1-13(2)12-17(18)16-10-8-15(9-11-16)14-6-4-3-5-7-14;1-12(2)13-6-8-14(9-7-13)15-11-18-10-4-3-5-16(18)17-15;1-10(2)11-6-3-4-9-14(11)18-15-12(16)7-5-8-13(15)17;1-9(2)10-3-5-12-13-8-11(16)4-6-14(13)17-15(12)7-10;1-12(2)13-7-6-10-15(11-13)16-14-8-4-3-5-9-14;1-10(2)12-8-9-13(16-12)14(15)11-6-4-3-5-7-11;1-10(2)12-5-6-13-7-11(9-15)3-4-14(13)8-12;1-10(2)9-12-5-7-13(8-6-12)11(3)4;1-3-2/h3-12H,2H2,1H3;3-11,13H,12H2,1-2H3;3-12H,1-2H3;3-10,18H,1-2H3;3-9,17H,1-2H3;3-12H,1-2H3;3-10H,1-2H3;3-8,10,15H,9H2,1-2H3;5-8,10-11H,9H2,1-4H3;3H2,1-2H3.
What are the key properties of 6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine?
6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine has a molecular weight of 2111.20 g/mol, XLogP of 41.82, 24 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-propan-2-yl-9H-carbazole;2,6-dichloro-N-(2-propan-2-ylphenyl)aniline;2-ethyl-4,5-diphenyl-1,3-oxazole;3-methyl-1-(4-phenylphenyl)butan-1-one;1-(2-methylpropyl)-4-propan-2-ylbenzene;1-phenoxy-3-propan-2-ylbenzene;phenyl-(5-propan-2-ylthiophen-2-yl)methanone;propane;(6-propan-2-ylnaphthalen-2-yl)methanol;2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 161084337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).