[4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol

C21H25N5O2 — CID 163362486

IUPAC[4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol
SMILESCOc1cc2nn(C3CCC(CO)CC3)cc2cc1N1CC=C2N=CC=CN21
InChIInChI=1S/C21H25N5O2/c1-28-20-12-18-16(13-24(23-18)17-5-3-15(14-27)4-6-17)11-19(20)25-10-7-21-22-8-2-9-26(21)25/h2,7-9,11-13,15,17,27H,3-6,10,14H2,1H3
InChIKeyHIKVMNGAKNUWAR-UHFFFAOYSA-N
MW379.46 g/mol
LogP3.24
Rot. Bonds4

About [4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol

[4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol (PubChem CID 163362486) has the molecular formula C21H25N5O2 and a molecular weight of 379.46 g/mol. Its IUPAC name is [4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol.

Molecular Properties

Compound Name[4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol
PubChem CID163362486
Molecular FormulaC21H25N5O2
Molecular Weight379.46 g/mol
Exact Mass379.20
IUPAC Name[4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol
SMILESCOc1cc2nn(C3CCC(CO)CC3)cc2cc1N1CC=C2N=CC=CN21
InChIInChI=1S/C21H25N5O2/c1-28-20-12-18-16(13-24(23-18)17-5-3-15(14-27)4-6-17)11-19(20)25-10-7-21-22-8-2-9-26(21)25/h2,7-9,11-13,15,17,27H,3-6,10,14H2,1H3
InChIKeyHIKVMNGAKNUWAR-UHFFFAOYSA-N
XLogP3.24
TPSA66.12 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze [4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol with MolForge

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Related Compounds

[4-[6-methoxy-5-(5-methoxy-2H-pyridin-1-yl)indazol-2-yl]cyclohexyl]methanol
CID 169226945
[4-(5-amino-6-methoxyindazol-2-yl)cyclohexyl]methanol
CID 155437469
[4-(6-methoxy-5-nitroindazol-2-yl)cyclohexyl]methanol
CID 162721663
1-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]-5-methyl-2H-pyridine-3-carboxamide
CID 170693376
1-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]-2H-pyrazine-2-carboxamide
CID 155438131
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
[4-(5-bromo-6-fluoroindazol-2-yl)cyclohexyl]methanol
CID 155437708
5-fluoro-N-[2-[4-(hydroxymethyl)cyclohexyl]-6-methoxyindazol-5-yl]-6-methylpyridine-2-carboxamide
CID 155438184
[4-[5-amino-6-(trifluoromethoxy)indazol-2-yl]cyclohexyl]methanol
CID 164567417
[4-[5-bromo-6-(trifluoromethoxy)indazol-2-yl]cyclohexyl]methanol
CID 155438039
[4-(5-amino-6-methylindazol-2-yl)cyclohexyl]methanol
CID 170379953

Frequently Asked Questions

What is the IUPAC name of [4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol?
The IUPAC name of [4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol (CID 163362486) is [4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol.
What is the SMILES notation for [4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol?
The canonical SMILES for [4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol is COc1cc2nn(C3CCC(CO)CC3)cc2cc1N1CC=C2N=CC=CN21.
What is the InChIKey of [4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol?
The InChIKey is HIKVMNGAKNUWAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O2/c1-28-20-12-18-16(13-24(23-18)17-5-3-15(14-27)4-6-17)11-19(20)25-10-7-21-22-8-2-9-26(21)25/h2,7-9,11-13,15,17,27H,3-6,10,14H2,1H3.
What are the key properties of [4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol?
[4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol has a molecular weight of 379.46 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[6-methoxy-5-(2H-pyrazolo[1,5-a]pyrimidin-1-yl)indazol-2-yl]cyclohexyl]methanol is sourced from PubChem (CID 163362486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).