1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol

C20H18N4O — CID 118664458

IUPAC1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol
SMILESCc1cccc(-n2ncc3ccc(-c4cccc(C(C)O)n4)cc32)n1
InChIInChI=1S/C20H18N4O/c1-13-5-3-8-20(22-13)24-19-11-15(9-10-16(19)12-21-24)18-7-4-6-17(23-18)14(2)25/h3-12,14,25H,1-2H3
InChIKeyMYAAEKZOFVJADW-UHFFFAOYSA-N
MW330.39 g/mol
LogP3.84
Rot. Bonds3

About 1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol

1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol (PubChem CID 118664458) has the molecular formula C20H18N4O and a molecular weight of 330.39 g/mol. Its IUPAC name is 1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol.

Molecular Properties

Compound Name1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol
PubChem CID118664458
Molecular FormulaC20H18N4O
Molecular Weight330.39 g/mol
Exact Mass330.15
IUPAC Name1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol
SMILESCc1cccc(-n2ncc3ccc(-c4cccc(C(C)O)n4)cc32)n1
InChIInChI=1S/C20H18N4O/c1-13-5-3-8-20(22-13)24-19-11-15(9-10-16(19)12-21-24)18-7-4-6-17(23-18)14(2)25/h3-12,14,25H,1-2H3
InChIKeyMYAAEKZOFVJADW-UHFFFAOYSA-N
XLogP3.84
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol?
The IUPAC name of 1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol (CID 118664458) is 1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol.
What is the SMILES notation for 1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol?
The canonical SMILES for 1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol is Cc1cccc(-n2ncc3ccc(-c4cccc(C(C)O)n4)cc32)n1.
What is the InChIKey of 1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol?
The InChIKey is MYAAEKZOFVJADW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4O/c1-13-5-3-8-20(22-13)24-19-11-15(9-10-16(19)12-21-24)18-7-4-6-17(23-18)14(2)25/h3-12,14,25H,1-2H3.
What are the key properties of 1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol?
1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol has a molecular weight of 330.39 g/mol, XLogP of 3.84, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[1-(6-methyl-2-pyridinyl)indazol-6-yl]-2-pyridinyl]ethanol is sourced from PubChem (CID 118664458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).