1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine

C149H181N25O — CID 157229969

IUPAC1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine
SMILESCC(C)c1ccc2c(c1)c(N)nn2C.CC(C)c1ccc2c(cnn2C)c1.CC(C)c1cccc(-c2ccc3c(cnn3C)c2)c1.CC(C)c1cccc(-c2ccc3c(cnn3C)c2)c1.CC(C)c1cccc(-c2ccnc(N3CCN(C)CC3)c2)c1.CC(C)c1cccc(-c2cncnc2)c1.CC(C)c1cnc2c(cnn2C)c1.CC(C)c1cnc2cn(C)nc2c1.COc1cncc(-c2cccc(C(C)C)c2)c1.Cc1c(-c2cccc(C(C)C)c2)cnn1C.Cc1cn(C)c2ncc(C(C)C)cc12
InChIInChI=1S/C19H25N3.2C17H18N2.C15H17NO.C14H18N2.C13H14N2.C12H16N2.C11H15N3.C11H14N2.2C10H13N3/c1-15(2)16-5-4-6-17(13-16)18-7-8-20-19(14-18)22-11-9-21(3)10-12-22;2*1-12(2)13-5-4-6-14(9-13)15-7-8-17-16(10-15)11-18-19(17)3;1-11(2)12-5-4-6-13(7-12)14-8-15(17-3)10-16-9-14;1-10(2)12-6-5-7-13(8-12)14-9-15-16(4)11(14)3;1-10(2)11-4-3-5-12(6-11)13-7-14-9-15-8-13;1-8(2)10-5-11-9(3)7-14(4)12(11)13-6-10;1-7(2)8-4-5-10-9(6-8)11(12)13-14(10)3;1-8(2)9-4-5-11-10(6-9)7-12-13(11)3;1-7(2)8-4-9-10(11-5-8)6-13(3)12-9;1-7(2)8-4-9-6-12-13(3)10(9)11-5-8/h4-8,13-15H,9-12H2,1-3H3;2*4-12H,1-3H3;4-11H,1-3H3;5-10H,1-4H3;3-10H,1-2H3;5-8H,1-4H3;4-7H,1-3H3,(H2,12,13);4-8H,1-3H3;2*4-7H,1-3H3
InChIKeyATZIMPRKRPKAOE-UHFFFAOYSA-N
MW2338.26 g/mol
LogP35.18
Rot. Bonds19

About 1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine

1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine (PubChem CID 157229969) has the molecular formula C149H181N25O and a molecular weight of 2338.26 g/mol. Its IUPAC name is 1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine.

Molecular Properties

Compound Name1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine
PubChem CID157229969
Molecular FormulaC149H181N25O
Molecular Weight2338.26 g/mol
Exact Mass2336.49
IUPAC Name1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine
SMILESCC(C)c1ccc2c(c1)c(N)nn2C.CC(C)c1ccc2c(cnn2C)c1.CC(C)c1cccc(-c2ccc3c(cnn3C)c2)c1.CC(C)c1cccc(-c2ccc3c(cnn3C)c2)c1.CC(C)c1cccc(-c2ccnc(N3CCN(C)CC3)c2)c1.CC(C)c1cccc(-c2cncnc2)c1.CC(C)c1cnc2c(cnn2C)c1.CC(C)c1cnc2cn(C)nc2c1.COc1cncc(-c2cccc(C(C)C)c2)c1.Cc1c(-c2cccc(C(C)C)c2)cnn1C.Cc1cn(C)c2ncc(C(C)C)cc12
InChIInChI=1S/C19H25N3.2C17H18N2.C15H17NO.C14H18N2.C13H14N2.C12H16N2.C11H15N3.C11H14N2.2C10H13N3/c1-15(2)16-5-4-6-17(13-16)18-7-8-20-19(14-18)22-11-9-21(3)10-12-22;2*1-12(2)13-5-4-6-14(9-13)15-7-8-17-16(10-15)11-18-19(17)3;1-11(2)12-5-4-6-13(7-12)14-8-15(17-3)10-16-9-14;1-10(2)12-6-5-7-13(8-12)14-9-15-16(4)11(14)3;1-10(2)11-4-3-5-12(6-11)13-7-14-9-15-8-13;1-8(2)10-5-11-9(3)7-14(4)12(11)13-6-10;1-7(2)8-4-5-10-9(6-8)11(12)13-14(10)3;1-8(2)9-4-5-11-10(6-9)7-12-13(11)3;1-7(2)8-4-9-10(11-5-8)6-13(3)12-9;1-7(2)8-4-9-6-12-13(3)10(9)11-5-8/h4-8,13-15H,9-12H2,1-3H3;2*4-12H,1-3H3;4-11H,1-3H3;5-10H,1-4H3;3-10H,1-2H3;5-8H,1-4H3;4-7H,1-3H3,(H2,12,13);4-8H,1-3H3;2*4-7H,1-3H3
InChIKeyATZIMPRKRPKAOE-UHFFFAOYSA-N
XLogP35.18
TPSA261.63 Ų
H-Bond Donors1
H-Bond Acceptors26
Rotatable Bonds19
Heavy Atoms175
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002338.26
LogP ≤ 535.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1026

Analyze 1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine with MolForge

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Launch Full Analysis

Related Compounds

6-[(1S)-1-[8-fluoro-6-(1-methylimidazol-4-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]ethyl]-3-methoxyquinoline
CID 118732961
US10544143, Example 1067
CID 138687106
(1R,4R)-5-[2-[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-6-[6-(4-methoxy-3-pyridinyl)-4-methylpyrazolo[4,3-c]pyridin-1-yl]-1-methylimidazo[4,5-c]pyridin-4-yl]-2-oxa-5-azabicyclo[2.2.1]heptane
CID 164514234
US10071079, Example 570
CID 132272422
US10071079, Example 565
CID 135376047
US10544143, Example 190
CID 138686244
US10544143, Example 168
CID 138686446
US10544143, Example 115
CID 138686483
US10544143, Example 91
CID 138686528
US10544143, Example 177
CID 138686534
US10544143, Example 174
CID 138686640
US10544143, Example 119
CID 138686784

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine?
The IUPAC name of 1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine (CID 157229969) is 1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine.
What is the SMILES notation for 1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine?
The canonical SMILES for 1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine is CC(C)c1ccc2c(c1)c(N)nn2C.CC(C)c1ccc2c(cnn2C)c1.CC(C)c1cccc(-c2ccc3c(cnn3C)c2)c1.CC(C)c1cccc(-c2ccc3c(cnn3C)c2)c1.CC(C)c1cccc(-c2ccnc(N3CCN(C)CC3)c2)c1.CC(C)c1cccc(-c2cncnc2)c1.CC(C)c1cnc2c(cnn2C)c1.CC(C)c1cnc2cn(C)nc2c1.COc1cncc(-c2cccc(C(C)C)c2)c1.Cc1c(-c2cccc(C(C)C)c2)cnn1C.Cc1cn(C)c2ncc(C(C)C)cc12.
What is the InChIKey of 1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine?
The InChIKey is ATZIMPRKRPKAOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3.2C17H18N2.C15H17NO.C14H18N2.C13H14N2.C12H16N2.C11H15N3.C11H14N2.2C10H13N3/c1-15(2)16-5-4-6-17(13-16)18-7-8-20-19(14-18)22-11-9-21(3)10-12-22;2*1-12(2)13-5-4-6-14(9-13)15-7-8-17-16(10-15)11-18-19(17)3;1-11(2)12-5-4-6-13(7-12)14-8-15(17-3)10-16-9-14;1-10(2)12-6-5-7-13(8-12)14-9-15-16(4)11(14)3;1-10(2)11-4-3-5-12(6-11)13-7-14-9-15-8-13;1-8(2)10-5-11-9(3)7-14(4)12(11)13-6-10;1-7(2)8-4-5-10-9(6-8)11(12)13-14(10)3;1-8(2)9-4-5-11-10(6-9)7-12-13(11)3;1-7(2)8-4-9-10(11-5-8)6-13(3)12-9;1-7(2)8-4-9-6-12-13(3)10(9)11-5-8/h4-8,13-15H,9-12H2,1-3H3;2*4-12H,1-3H3;4-11H,1-3H3;5-10H,1-4H3;3-10H,1-2H3;5-8H,1-4H3;4-7H,1-3H3,(H2,12,13);4-8H,1-3H3;2*4-7H,1-3H3.
What are the key properties of 1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine?
1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine has a molecular weight of 2338.26 g/mol, XLogP of 35.18, 19 rotatable bonds, 1 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-4-(3-propan-2-ylphenyl)pyrazole;1,3-dimethyl-5-propan-2-ylpyrrolo[2,3-b]pyridine;3-methoxy-5-(3-propan-2-ylphenyl)pyridine;1-methyl-5-propan-2-ylindazol-3-amine;1-methyl-5-propan-2-ylindazole;bis(1-methyl-5-(3-propan-2-ylphenyl)indazole);1-methyl-4-[4-(3-propan-2-ylphenyl)-2-pyridinyl]piperazine;1-methyl-5-propan-2-ylpyrazolo[3,4-b]pyridine;2-methyl-6-propan-2-ylpyrazolo[4,3-b]pyridine;5-(3-propan-2-ylphenyl)pyrimidine is sourced from PubChem (CID 157229969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).