(2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol

C20H19N5O — CID 164611914

IUPAC(2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol
SMILESCc1[nH]nc2ccc(-c3cncc(N[C@@H](CO)c4ccccc4)n3)cc12
InChIInChI=1S/C20H19N5O/c1-13-16-9-15(7-8-17(16)25-24-13)18-10-21-11-20(22-18)23-19(12-26)14-5-3-2-4-6-14/h2-11,19,26H,12H2,1H3,(H,22,23)(H,24,25)/t19-/m0/s1
InChIKeyWQCXLUNOPQPYFK-IBGZPJMESA-N
MW345.41 g/mol
LogP3.47
Rot. Bonds5

About (2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol

(2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol (PubChem CID 164611914) has the molecular formula C20H19N5O and a molecular weight of 345.41 g/mol. Its IUPAC name is (2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol.

Molecular Properties

Compound Name(2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol
PubChem CID164611914
Molecular FormulaC20H19N5O
Molecular Weight345.41 g/mol
Exact Mass345.16
IUPAC Name(2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol
SMILESCc1[nH]nc2ccc(-c3cncc(N[C@@H](CO)c4ccccc4)n3)cc12
InChIInChI=1S/C20H19N5O/c1-13-16-9-15(7-8-17(16)25-24-13)18-10-21-11-20(22-18)23-19(12-26)14-5-3-2-4-6-14/h2-11,19,26H,12H2,1H3,(H,22,23)(H,24,25)/t19-/m0/s1
InChIKeyWQCXLUNOPQPYFK-IBGZPJMESA-N
XLogP3.47
TPSA86.72 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.41
LogP ≤ 53.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze (2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol with MolForge

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Related Compounds

6-[5-(2,6-difluorophenyl)-1H-indazol-3-yl]-N-piperidin-4-ylpyrazin-2-amine
CID 67959617
1-[6-[5-(2,6-difluorophenyl)-1H-indazol-3-yl]pyrazin-2-yl]piperidin-4-amine
CID 67959736
Cdk8-IN-4
CID 75202254
4-(4-(5-(1-Methyl-1H-pyrazol-4-yl)-1H-indazol-3-yl)pyridin-2-yl)morpholine
CID 90401078
2-methyl-1-[[3-propan-2-yl-7-[(4-pyridin-2-ylphenyl)methylamino]-2H-pyrazolo[4,3-d]pyrimidin-5-yl]amino]propan-2-ol
CID 127030850
(R)-2-Phenyl-2-{1-[3-(5-[1,2,4]triazol-1-ylmethyl-1H-indol-3-yl)-propyl]-piperidin-4-ylamino}-ethanol
CID 10837591
5-(1H-indazol-5-yl)-3-(4-methyl-1,4-diazepan-1-yl)pyrazin-2-amine
CID 11560302
4-[[4-(1H-indazol-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol
CID 24960635
3-(cyclohexylmethyl)-5-(1H-indazol-5-yl)-1H-imidazo[4,5-b]pyrazin-2-one
CID 24985365
n-Cyclohexyl-2-(1h-indazol-5-yl)imidazo[1,2-a]pyrimidin-3-amine
CID 25167072
2-(1h-Indazol-5-yl)-n-isopropylimidazo[1,2-a]pyrimidin-3-amine
CID 25167074
2-[[2-[(1S)-1-amino-2-(3-fluorophenyl)ethyl]-6-(1H-pyrazol-4-yl)quinazolin-4-yl]-methylamino]ethanol
CID 46207055

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol?
The IUPAC name of (2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol (CID 164611914) is (2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol.
What is the SMILES notation for (2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol?
The canonical SMILES for (2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol is Cc1[nH]nc2ccc(-c3cncc(N[C@@H](CO)c4ccccc4)n3)cc12.
What is the InChIKey of (2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol?
The InChIKey is WQCXLUNOPQPYFK-IBGZPJMESA-N. The full InChI is InChI=1S/C20H19N5O/c1-13-16-9-15(7-8-17(16)25-24-13)18-10-21-11-20(22-18)23-19(12-26)14-5-3-2-4-6-14/h2-11,19,26H,12H2,1H3,(H,22,23)(H,24,25)/t19-/m0/s1.
What are the key properties of (2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol?
(2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol has a molecular weight of 345.41 g/mol, XLogP of 3.47, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]-2-phenylethanol is sourced from PubChem (CID 164611914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).