4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole

C87H105ClF2N16 — CID 157411304

IUPAC4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole
SMILESCC(C)c1cc2cn[nH]c2cc1F.CC(C)c1ccc2[nH]ncc2c1.CC(C)c1ccc2[nH]ncc2c1C1CC1.CC(C)c1ccc2[nH]ncc2c1Cl.CC(C)c1ccc2[nH]ncc2c1F.CCc1c(C(C)C)ccc2[nH]ncc12.Cc1[nH]nc2ccc(C(C)C)cc12.Cc1c(C(C)C)ccc2[nH]ncc12
InChIInChI=1S/C13H16N2.C12H16N2.2C11H14N2.C10H11ClN2.2C10H11FN2.C10H12N2/c1-8(2)10-5-6-12-11(7-14-15-12)13(10)9-3-4-9;1-4-9-10(8(2)3)5-6-12-11(9)7-13-14-12;1-7(2)9-4-5-11-10(8(9)3)6-12-13-11;1-7(2)9-4-5-11-10(6-9)8(3)12-13-11;1-6(2)7-3-4-9-8(10(7)11)5-12-13-9;1-6(2)8-3-7-5-12-13-10(7)4-9(8)11;1-6(2)7-3-4-9-8(10(7)11)5-12-13-9;1-7(2)8-3-4-10-9(5-8)6-11-12-10/h5-9H,3-4H2,1-2H3,(H,14,15);5-8H,4H2,1-3H3,(H,13,14);2*4-7H,1-3H3,(H,12,13);3*3-6H,1-2H3,(H,12,13);3-7H,1-2H3,(H,11,12)
InChIKeyBOHXZMVICNRZJG-UHFFFAOYSA-N
MW1448.36 g/mol
LogP24.48
Rot. Bonds10

About 4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole

4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole (PubChem CID 157411304) has the molecular formula C87H105ClF2N16 and a molecular weight of 1448.36 g/mol. Its IUPAC name is 4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole.

Molecular Properties

Compound Name4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole
PubChem CID157411304
Molecular FormulaC87H105ClF2N16
Molecular Weight1448.36 g/mol
Exact Mass1446.84
IUPAC Name4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole
SMILESCC(C)c1cc2cn[nH]c2cc1F.CC(C)c1ccc2[nH]ncc2c1.CC(C)c1ccc2[nH]ncc2c1C1CC1.CC(C)c1ccc2[nH]ncc2c1Cl.CC(C)c1ccc2[nH]ncc2c1F.CCc1c(C(C)C)ccc2[nH]ncc12.Cc1[nH]nc2ccc(C(C)C)cc12.Cc1c(C(C)C)ccc2[nH]ncc12
InChIInChI=1S/C13H16N2.C12H16N2.2C11H14N2.C10H11ClN2.2C10H11FN2.C10H12N2/c1-8(2)10-5-6-12-11(7-14-15-12)13(10)9-3-4-9;1-4-9-10(8(2)3)5-6-12-11(9)7-13-14-12;1-7(2)9-4-5-11-10(8(9)3)6-12-13-11;1-7(2)9-4-5-11-10(6-9)8(3)12-13-11;1-6(2)7-3-4-9-8(10(7)11)5-12-13-9;1-6(2)8-3-7-5-12-13-10(7)4-9(8)11;1-6(2)7-3-4-9-8(10(7)11)5-12-13-9;1-7(2)8-3-4-10-9(5-8)6-11-12-10/h5-9H,3-4H2,1-2H3,(H,14,15);5-8H,4H2,1-3H3,(H,13,14);2*4-7H,1-3H3,(H,12,13);3*3-6H,1-2H3,(H,12,13);3-7H,1-2H3,(H,11,12)
InChIKeyBOHXZMVICNRZJG-UHFFFAOYSA-N
XLogP24.48
TPSA229.44 Ų
H-Bond Donors8
H-Bond Acceptors8
Rotatable Bonds10
Heavy Atoms106
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001448.36
LogP ≤ 524.48
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 108

Analyze 4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole with MolForge

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Related Compounds

4-tert-butyl-5-chloro-1H-indazole;bis(4-tert-butyl-5,6-dimethyl-1H-indazole);4-tert-butyl-5-methyl-1H-indazole;4-tert-butyl-5-(trifluoromethyl)-1H-indazole
CID 159495345
8-tert-butyl-1-chloro-2-fluoronaphthalene;4-tert-butyl-5-chloro-1H-indazole;1-tert-butyl-8-chloronaphthalene;4-tert-butyl-2,3-dihydro-1H-indene;4-tert-butyl-5-methyl-1H-indazole;1-tert-butyl-8-methylnaphthalene;1-tert-butylnaphthalene;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;1-chloro-3-propan-2-yl-2-(trifluoromethyl)benzene;1,8-dimethylnaphthalene;1,3-di(propan-2-yl)benzene;ethane;1-fluoro-8-propan-2-ylnaphthalene;1-methylnaphthalene;tris(1-methyl-8-propan-2-ylnaphthalene);4-propan-2-yl-1H-indazole;1-propan-2-ylnaphthalene;1-propan-2-yl-8-(trideuteriomethyl)naphthalene
CID 164964699
8-tert-butyl-1-chloro-2-fluoronaphthalene;4-tert-butyl-5-chloro-1H-indazole;1-tert-butyl-8-chloronaphthalene;1-tert-butyl-2-cyclopropylbenzene;4-tert-butyl-2,3-dihydro-1H-indene;4-tert-butyl-5-methyl-1H-indazole;1-tert-butyl-8-methylnaphthalene;1-tert-butylnaphthalene;5-tert-butyl-1,2,3,4-tetrahydronaphthalene;1-tert-butyl-2-(trifluoromethyl)benzene;1-chloro-3-propan-2-yl-2-(trifluoromethyl)benzene;1,8-dimethylnaphthalene;1,3-di(propan-2-yl)benzene;ethane;1-fluoro-8-propan-2-ylnaphthalene;1-methylnaphthalene;tris(1-methyl-8-propan-2-ylnaphthalene);4-propan-2-yl-1H-indazole;1-propan-2-ylnaphthalene;1-propan-2-yl-8-(trideuteriomethyl)naphthalene
CID 165074484
5-tert-butyl-7-chloro-1H-indazole;5-tert-butyl-7-fluoro-2-methylidene-1,3-dihydroindole;5-tert-butyl-1H-indazole;5-tert-butyl-7-methyl-1H-indazole;5-tert-butyl-7-methyl-2-methylidene-1,3-dihydroindole
CID 158292425
5-chloro-6-fluoro-4-propan-2-yl-1H-indazole;5-chloro-6-methyl-4-propan-2-yl-1H-indazole;6-chloro-5-methyl-4-propan-2-yl-1H-indazole;5-chloro-4-propan-2-yl-1H-indazole;5,6-dichloro-4-propan-2-yl-1H-indazole;5-methyl-4-propan-2-yl-1H-indazole
CID 160571107
4-propan-2-yl-1-tritioindazole;4-propan-2-yl-3-tritio-1H-indazole;4-propan-2-yl-5-tritio-1H-indazole;4-propan-2-yl-6-tritio-1H-indazole;4-propan-2-yl-7-tritio-1H-indazole
CID 160634681
6-chloro-5-methyl-4-propan-2-yl-1H-indazole;5,6-dichloro-4-propan-2-yl-1H-indazole;5,6-dimethyl-4-propan-2-yl-1H-indazole;6-fluoro-5-methyl-4-propan-2-yl-1H-indazole;bis(5-methyl-4-propan-2-yl-1H-indazole)
CID 160927870
4-tert-butyl-5-fluoro-6-methyl-1H-indazole;5-chloro-6-fluoro-4-propan-2-yl-1H-indazole;5-chloro-6-methyl-4-propan-2-yl-1H-indazole;6-chloro-5-methyl-4-propan-2-yl-1H-indazole;5-chloro-4-propan-2-yl-1H-indazole;5,6-dichloro-4-propan-2-yl-1H-indazole;5-methyl-4-propan-2-yl-1H-indazole
CID 161084633
bis(4-methyl-1H-indazole);bis(5-methyl-1H-indazole);bis(6-methyl-1H-indazole)
CID 161168467
4-chloro-5-propan-2-yl-1H-indazole;4-methyl-5-propan-2-yl-1H-indazole
CID 161234327
5-chloro-6-fluoro-4-propan-2-yl-1H-indazole;5-chloro-6-methyl-4-propan-2-yl-1H-indazole;6-chloro-5-methyl-4-propan-2-yl-1H-indazole;5-chloro-4-propan-2-yl-1H-indazole;5,6-dichloro-4-propan-2-yl-1H-indazole;5-fluoro-6-methyl-4-propan-2-yl-1H-indazole;5-methyl-4-propan-2-yl-1H-indazole
CID 161483498
1,2-di(propan-2-yl)benzene;bis(4,5-di(propan-2-yl)-1H-indazole);5,6-di(propan-2-yl)-1H-indazole;5,6-di(propan-2-yl)-1H-isoindole;ethane
CID 161671474

Frequently Asked Questions

What is the IUPAC name of 4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole?
The IUPAC name of 4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole (CID 157411304) is 4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole.
What is the SMILES notation for 4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole?
The canonical SMILES for 4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole is CC(C)c1cc2cn[nH]c2cc1F.CC(C)c1ccc2[nH]ncc2c1.CC(C)c1ccc2[nH]ncc2c1C1CC1.CC(C)c1ccc2[nH]ncc2c1Cl.CC(C)c1ccc2[nH]ncc2c1F.CCc1c(C(C)C)ccc2[nH]ncc12.Cc1[nH]nc2ccc(C(C)C)cc12.Cc1c(C(C)C)ccc2[nH]ncc12.
What is the InChIKey of 4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole?
The InChIKey is BOHXZMVICNRZJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2.C12H16N2.2C11H14N2.C10H11ClN2.2C10H11FN2.C10H12N2/c1-8(2)10-5-6-12-11(7-14-15-12)13(10)9-3-4-9;1-4-9-10(8(2)3)5-6-12-11(9)7-13-14-12;1-7(2)9-4-5-11-10(8(9)3)6-12-13-11;1-7(2)9-4-5-11-10(6-9)8(3)12-13-11;1-6(2)7-3-4-9-8(10(7)11)5-12-13-9;1-6(2)8-3-7-5-12-13-10(7)4-9(8)11;1-6(2)7-3-4-9-8(10(7)11)5-12-13-9;1-7(2)8-3-4-10-9(5-8)6-11-12-10/h5-9H,3-4H2,1-2H3,(H,14,15);5-8H,4H2,1-3H3,(H,13,14);2*4-7H,1-3H3,(H,12,13);3*3-6H,1-2H3,(H,12,13);3-7H,1-2H3,(H,11,12).
What are the key properties of 4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole?
4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole has a molecular weight of 1448.36 g/mol, XLogP of 24.48, 10 rotatable bonds, 8 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5-propan-2-yl-1H-indazole;4-cyclopropyl-5-propan-2-yl-1H-indazole;4-ethyl-5-propan-2-yl-1H-indazole;4-fluoro-5-propan-2-yl-1H-indazole;6-fluoro-5-propan-2-yl-1H-indazole;3-methyl-5-propan-2-yl-2H-indazole;4-methyl-5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indazole is sourced from PubChem (CID 157411304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).