5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole

C22H22ClN7 — CID 155381288

IUPAC5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole
SMILESClc1cc2cnn(-c3cnn(C4CC4)c3)c2cc1N1CCC(c2cnccn2)CC1
InChIInChI=1S/C22H22ClN7/c23-19-9-16-11-27-30(18-12-26-29(14-18)17-1-2-17)21(16)10-22(19)28-7-3-15(4-8-28)20-13-24-5-6-25-20/h5-6,9-15,17H,1-4,7-8H2
InChIKeyOLAOYCUWKBQIQH-UHFFFAOYSA-N
MW419.92 g/mol
LogP4.38
Rot. Bonds4

About 5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole

5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole (PubChem CID 155381288) has the molecular formula C22H22ClN7 and a molecular weight of 419.92 g/mol. Its IUPAC name is 5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole.

Molecular Properties

Compound Name5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole
PubChem CID155381288
Molecular FormulaC22H22ClN7
Molecular Weight419.92 g/mol
Exact Mass419.16
IUPAC Name5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole
SMILESClc1cc2cnn(-c3cnn(C4CC4)c3)c2cc1N1CCC(c2cnccn2)CC1
InChIInChI=1S/C22H22ClN7/c23-19-9-16-11-27-30(18-12-26-29(14-18)17-1-2-17)21(16)10-22(19)28-7-3-15(4-8-28)20-13-24-5-6-25-20/h5-6,9-15,17H,1-4,7-8H2
InChIKeyOLAOYCUWKBQIQH-UHFFFAOYSA-N
XLogP4.38
TPSA64.66 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.92
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

(3R,4S)-1-[5-chloro-1-(1-cyclopropylpyrazol-4-yl)indazol-6-yl]-3-fluoropiperidin-4-amine
CID 155381685
(3R,4R)-1-[5-chloro-1-(1-cyclopropylpyrazol-4-yl)indazol-6-yl]-3-fluoropiperidin-4-amine
CID 155381644
5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-[4-(2,2,4,4-tetradeuterio-3-methyloxetan-3-yl)piperazin-1-yl]indazole
CID 164848101
(1S,5R)-3-[5-chloro-1-(1-cyclopropylpyrazol-4-yl)indazol-6-yl]-8-pyridin-3-yl-3-azabicyclo[3.2.1]octan-8-ol
CID 164848102
8-[5-chloro-1-(1-cyclopropylpyrazol-4-yl)indazol-6-yl]-3,3-difluoro-1,8-diazaspiro[4.5]decane
CID 155381686
7-[5-chloro-1-(1-cyclopropylpyrazol-4-yl)indazol-6-yl]-6-oxa-3,7-diazabicyclo[3.1.1]heptane
CID 155381725
(1S,5S,8S)-3-[5-chloro-1-(1-cyclopropylpyrazol-4-yl)indazol-6-yl]-8-methyl-6-oxa-3-azabicyclo[3.2.1]octan-8-ol
CID 164848050
3-[4-[5-chloro-6-[4-(3-methyloxetan-3-yl)piperazin-1-yl]indazol-1-yl]pyrazol-1-yl]cyclobutane-1-carboxylic acid
CID 155368983
3-[1-(1-cyclopropylpyrazol-4-yl)-5-methylindazol-6-yl]-8-methyl-3-azabicyclo[3.2.1]octan-8-ol
CID 155381655
2-[5-chloro-1-(1-cyclopropylpyrazol-4-yl)indazol-6-yl]-2,7-diazaspiro[4.4]nonan-8-one;2-[5-chloro-1-(1-cyclopropylpyrazol-4-yl)indazol-6-yl]-2,7-diazaspiro[3.4]octan-6-one;8-[5-chloro-1-(1-cyclopropylpyrazol-4-yl)indazol-6-yl]-2-methyl-2,8-diazaspiro[4.5]decan-3-one;5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-[4-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]indazole;5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazol-1-ylpiperidin-1-yl)indazole
CID 167707325
1-[1-[1-(1-bicyclo[1.1.1]pentanyl)pyrazol-4-yl]-5-chloroindazol-6-yl]-4-(oxolan-3-yl)piperidin-4-ol
CID 155381688
3-[1-(1-cyclopropylpyrazol-4-yl)-5-isocyanoindazol-6-yl]-8-methyl-3-azabicyclo[3.2.1]octan-8-ol
CID 164848122

Frequently Asked Questions

What is the IUPAC name of 5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole?
The IUPAC name of 5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole (CID 155381288) is 5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole.
What is the SMILES notation for 5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole?
The canonical SMILES for 5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole is Clc1cc2cnn(-c3cnn(C4CC4)c3)c2cc1N1CCC(c2cnccn2)CC1.
What is the InChIKey of 5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole?
The InChIKey is OLAOYCUWKBQIQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22ClN7/c23-19-9-16-11-27-30(18-12-26-29(14-18)17-1-2-17)21(16)10-22(19)28-7-3-15(4-8-28)20-13-24-5-6-25-20/h5-6,9-15,17H,1-4,7-8H2.
What are the key properties of 5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole?
5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole has a molecular weight of 419.92 g/mol, XLogP of 4.38, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-1-(1-cyclopropylpyrazol-4-yl)-6-(4-pyrazin-2-ylpiperidin-1-yl)indazole is sourced from PubChem (CID 155381288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).