2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol

C14H22N6O2 — CID 8547617

IUPAC2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol
SMILESC[C@@H]1CN(c2nc(NCCO)c3cnn(C)c3n2)C[C@@H](C)O1
InChIInChI=1S/C14H22N6O2/c1-9-7-20(8-10(2)22-9)14-17-12(15-4-5-21)11-6-16-19(3)13(11)18-14/h6,9-10,21H,4-5,7-8H2,1-3H3,(H,15,17,18)/t9-,10-/m1/s1
InChIKeySNWQUTSRIFBECH-NXEZZACHSA-N
MW306.37 g/mol
LogP0.38
Rot. Bonds4

About 2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol

2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol (PubChem CID 8547617) has the molecular formula C14H22N6O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is 2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol.

Molecular Properties

Compound Name2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol
PubChem CID8547617
Molecular FormulaC14H22N6O2
Molecular Weight306.37 g/mol
Exact Mass306.18
IUPAC Name2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol
SMILESC[C@@H]1CN(c2nc(NCCO)c3cnn(C)c3n2)C[C@@H](C)O1
InChIInChI=1S/C14H22N6O2/c1-9-7-20(8-10(2)22-9)14-17-12(15-4-5-21)11-6-16-19(3)13(11)18-14/h6,9-10,21H,4-5,7-8H2,1-3H3,(H,15,17,18)/t9-,10-/m1/s1
InChIKeySNWQUTSRIFBECH-NXEZZACHSA-N
XLogP0.38
TPSA88.33 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol with MolForge

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Related Compounds

6-(2,6-dimethylmorpholin-4-yl)-N-(3-methoxyphenyl)-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 43845722
1-methyl-N-propyl-6-pyrrolidin-1-ylpyrazolo[3,4-d]pyrimidin-4-amine
CID 50795315
1-methyl-6-(4-methylpiperazin-1-yl)-N-propylpyrazolo[3,4-d]pyrimidin-4-amine
CID 50795322
(2R,6S)-2,6-dimethyl-4-[1-methyl-6-(3-methylpyrrolidin-1-yl)pyrazolo[5,4-d]pyrimidin-4-yl]morpholine
CID 166397967
2-[[6-(1-adamantylamino)-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol
CID 8547521
(2S,6R)-4-(6-ethyl-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2,6-dimethylmorpholine
CID 56899248
N-benzyl-1-methyl-6-(4-methylpiperidin-1-yl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 8547227
2-[4-[1-methyl-4-(propan-2-ylamino)pyrazolo[3,4-d]pyrimidin-6-yl]piperazin-1-yl]ethanol
CID 50795417
2-[[6-(4-chloro-2-methylanilino)-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol
CID 8547730
N-benzyl-1-methyl-6-morpholin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine
CID 8547141
2-[4-[4-[(2-chlorophenyl)methylamino]-1-methylpyrazolo[3,4-d]pyrimidin-6-yl]piperazin-1-yl]ethanol
CID 50795107
(2S,6S)-2,6-dimethyl-4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine
CID 7197181

Frequently Asked Questions

What is the IUPAC name of 2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol?
The IUPAC name of 2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol (CID 8547617) is 2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol.
What is the SMILES notation for 2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol?
The canonical SMILES for 2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol is C[C@@H]1CN(c2nc(NCCO)c3cnn(C)c3n2)C[C@@H](C)O1.
What is the InChIKey of 2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol?
The InChIKey is SNWQUTSRIFBECH-NXEZZACHSA-N. The full InChI is InChI=1S/C14H22N6O2/c1-9-7-20(8-10(2)22-9)14-17-12(15-4-5-21)11-6-16-19(3)13(11)18-14/h6,9-10,21H,4-5,7-8H2,1-3H3,(H,15,17,18)/t9-,10-/m1/s1.
What are the key properties of 2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol?
2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol has a molecular weight of 306.37 g/mol, XLogP of 0.38, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]amino]ethanol is sourced from PubChem (CID 8547617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).