[4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol

C21H27N3O3 — CID 169226945

IUPAC[4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol
SMILESCOC1=CN(c2cc3cn(C4CCC(CO)CC4)nc3cc2OC)CC=C1
InChIInChI=1S/C21H27N3O3/c1-26-18-4-3-9-23(13-18)20-10-16-12-24(22-19(16)11-21(20)27-2)17-7-5-15(14-25)6-8-17/h3-4,10-13,15,17,25H,5-9,14H2,1-2H3
InChIKeyZDLXKFXZKSPVQJ-UHFFFAOYSA-N
MW369.47 g/mol
LogP3.63
Rot. Bonds5

About [4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol

[4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol (PubChem CID 169226945) has the molecular formula C21H27N3O3 and a molecular weight of 369.47 g/mol. Its IUPAC name is [4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol.

Molecular Properties

Compound Name[4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol
PubChem CID169226945
Molecular FormulaC21H27N3O3
Molecular Weight369.47 g/mol
Exact Mass369.21
IUPAC Name[4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol
SMILESCOC1=CN(c2cc3cn(C4CCC(CO)CC4)nc3cc2OC)CC=C1
InChIInChI=1S/C21H27N3O3/c1-26-18-4-3-9-23(13-18)20-10-16-12-24(22-19(16)11-21(20)27-2)17-7-5-15(14-25)6-8-17/h3-4,10-13,15,17,25H,5-9,14H2,1-2H3
InChIKeyZDLXKFXZKSPVQJ-UHFFFAOYSA-N
XLogP3.63
TPSA59.75 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.47
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]-5-methyl-2H-pyridine-3-carboxamide
CID 170693376
[4-(5-amino-6-methoxyindazol-2-yl)cyclohexyl]methanol
CID 155437469
[4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol
CID 163362486
[4-(6-methoxy-5-nitroindazol-2-yl)cyclohexyl]methanol
CID 162721663
1-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]-2H-pyrazine-2-carboxamide
CID 155438131
5-fluoro-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]-6-methylpyridine-2-carboxamide
CID 155438184
N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]-4-(trifluoromethyl)-1,3-thiazole-2-carboxamide
CID 155437771
6-(2-fluoropropan-2-yl)-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide
CID 155438263
2-[5-bromo-2-[4-(hydroxymethyl)cyclohexyl]indazol-6-yl]oxypropanoic acid
CID 155437454
[4-(5-bromo-6-fluoroindazol-2-yl)cyclohexyl]methanol
CID 155437708
[4-(5-amino-6-methylindazol-2-yl)cyclohexyl]methanol
CID 170379953
[4-[5-amino-6-(trifluoromethoxy)indazol-2-yl]cyclohexyl]methanol
CID 164567417

Frequently Asked Questions

What is the IUPAC name of [4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol?
The IUPAC name of [4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol (CID 169226945) is [4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol.
What is the SMILES notation for [4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol?
The canonical SMILES for [4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol is COC1=CN(c2cc3cn(C4CCC(CO)CC4)nc3cc2OC)CC=C1.
What is the InChIKey of [4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol?
The InChIKey is ZDLXKFXZKSPVQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N3O3/c1-26-18-4-3-9-23(13-18)20-10-16-12-24(22-19(16)11-21(20)27-2)17-7-5-15(14-25)6-8-17/h3-4,10-13,15,17,25H,5-9,14H2,1-2H3.
What are the key properties of [4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol?
[4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol has a molecular weight of 369.47 g/mol, XLogP of 3.63, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol is sourced from PubChem (CID 169226945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).