[5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol

C18H22N4O — CID 91765199

IUPAC[5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol
SMILESCc1ccc2c(c1)cc(CN1CCn3nc(CO)cc3C1)n2C
InChIInChI=1S/C18H22N4O/c1-13-3-4-18-14(7-13)8-16(20(18)2)10-21-5-6-22-17(11-21)9-15(12-23)19-22/h3-4,7-9,23H,5-6,10-12H2,1-2H3
InChIKeyOGZTYDOQYLLIKA-UHFFFAOYSA-N
MW310.40 g/mol
LogP2.19
Rot. Bonds3

About [5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol

[5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol (PubChem CID 91765199) has the molecular formula C18H22N4O and a molecular weight of 310.40 g/mol. Its IUPAC name is [5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol.

Molecular Properties

Compound Name[5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol
PubChem CID91765199
Molecular FormulaC18H22N4O
Molecular Weight310.40 g/mol
Exact Mass310.18
IUPAC Name[5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol
SMILESCc1ccc2c(c1)cc(CN1CCn3nc(CO)cc3C1)n2C
InChIInChI=1S/C18H22N4O/c1-13-3-4-18-14(7-13)8-16(20(18)2)10-21-5-6-22-17(11-21)9-15(12-23)19-22/h3-4,7-9,23H,5-6,10-12H2,1-2H3
InChIKeyOGZTYDOQYLLIKA-UHFFFAOYSA-N
XLogP2.19
TPSA46.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol with MolForge

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Related Compounds

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CID 90252812
1-(3,5-dimethyl-1H-pyrazol-1-yl)-3-(2,3,5-trimethyl-1H-indol-1-yl)propan-2-ol
CID 652327
[3-Ethyl-1-(hydroxymethyl)-11-methyl-5,6-dihydroindolizino[8,7-b]indol-2-yl]methanol
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[1-(Hydroxymethyl)-3,11-dimethyl-5,6-dihydroindolizino[8,7-b]indol-2-yl]methanol
CID 137650104
[1-methyl-9-[[1-[(E)-3-phenylprop-2-enyl]triazol-4-yl]methyl]pyrido[3,4-b]indol-3-yl]methanol
CID 164610681
[5-(1-Benzylindazol-3-yl)-1-methylpyrrol-2-yl]methanol
CID 11197913
(1-methyl-1H-pyrazol-5-yl){5-[(2E)-3-phenylprop-2-en-1-yl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-yl}methanol
CID 90648327
1-(3,5-Dimethylpyrazol-1-yl)-3-(6-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)propan-2-ol
CID 4146826
{5-[2-(1H-indol-3-yl)ethyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-yl}methanol
CID 91793719
(1S)-1-[5-(6-fluoro-2-methylquinolin-4-yl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]propan-1-ol
CID 99972948
(1S)-1-[5-[(1-naphthalen-2-ylpyrazol-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]ethanol
CID 100049107
1,1,1,3,3,3-Hexafluoro-2-[2-methyl-1-[[2-methyl-5-[4-(trifluoromethyl)phenyl]pyrazol-3-yl]methyl]indol-5-yl]propan-2-ol
CID 21082160

Frequently Asked Questions

What is the IUPAC name of [5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol?
The IUPAC name of [5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol (CID 91765199) is [5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol.
What is the SMILES notation for [5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol?
The canonical SMILES for [5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol is Cc1ccc2c(c1)cc(CN1CCn3nc(CO)cc3C1)n2C.
What is the InChIKey of [5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol?
The InChIKey is OGZTYDOQYLLIKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O/c1-13-3-4-18-14(7-13)8-16(20(18)2)10-21-5-6-22-17(11-21)9-15(12-23)19-22/h3-4,7-9,23H,5-6,10-12H2,1-2H3.
What are the key properties of [5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol?
[5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol has a molecular weight of 310.40 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(1,5-dimethylindol-2-yl)methyl]-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-2-yl]methanol is sourced from PubChem (CID 91765199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).