5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole

C23H34N4 — CID 164753147

IUPAC5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole
SMILESCC1CC=C(c2ccc3nn(C4CC(C)(C)N(C)C(C)(C)C4)cc3c2)NC1
InChIInChI=1S/C23H34N4/c1-16-7-9-20(24-14-16)17-8-10-21-18(11-17)15-27(25-21)19-12-22(2,3)26(6)23(4,5)13-19/h8-11,15-16,19,24H,7,12-14H2,1-6H3
InChIKeyOKYFMFTXBBYVKL-UHFFFAOYSA-N
MW366.55 g/mol
LogP4.83
Rot. Bonds2

About 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole

5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole (PubChem CID 164753147) has the molecular formula C23H34N4 and a molecular weight of 366.55 g/mol. Its IUPAC name is 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole.

Molecular Properties

Compound Name5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole
PubChem CID164753147
Molecular FormulaC23H34N4
Molecular Weight366.55 g/mol
Exact Mass366.28
IUPAC Name5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole
SMILESCC1CC=C(c2ccc3nn(C4CC(C)(C)N(C)C(C)(C)C4)cc3c2)NC1
InChIInChI=1S/C23H34N4/c1-16-7-9-20(24-14-16)17-8-10-21-18(11-17)15-27(25-21)19-12-22(2,3)26(6)23(4,5)13-19/h8-11,15-16,19,24H,7,12-14H2,1-6H3
InChIKeyOKYFMFTXBBYVKL-UHFFFAOYSA-N
XLogP4.83
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.55
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole?
The IUPAC name of 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole (CID 164753147) is 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole.
What is the SMILES notation for 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole?
The canonical SMILES for 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole is CC1CC=C(c2ccc3nn(C4CC(C)(C)N(C)C(C)(C)C4)cc3c2)NC1.
What is the InChIKey of 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole?
The InChIKey is OKYFMFTXBBYVKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H34N4/c1-16-7-9-20(24-14-16)17-8-10-21-18(11-17)15-27(25-21)19-12-22(2,3)26(6)23(4,5)13-19/h8-11,15-16,19,24H,7,12-14H2,1-6H3.
What are the key properties of 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole?
5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole has a molecular weight of 366.55 g/mol, XLogP of 4.83, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methyl-1,2,3,4-tetrahydropyridin-6-yl)-2-(1,2,2,6,6-pentamethylpiperidin-4-yl)indazole is sourced from PubChem (CID 164753147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).