(1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol

C10H13N3O — CID 78930822

IUPAC(1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol
SMILESCc1cc2ncc([C@H](C)O)c(C)n2n1
InChIInChI=1S/C10H13N3O/c1-6-4-10-11-5-9(8(3)14)7(2)13(10)12-6/h4-5,8,14H,1-3H3/t8-/m0/s1
InChIKeyUZWQAQDOZRXXMO-QMMMGPOBSA-N
MW191.23 g/mol
LogP1.40
Rot. Bonds1

About (1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol

(1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol (PubChem CID 78930822) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is (1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol.

Molecular Properties

Compound Name(1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol
PubChem CID78930822
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name(1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol
SMILESCc1cc2ncc([C@H](C)O)c(C)n2n1
InChIInChI=1S/C10H13N3O/c1-6-4-10-11-5-9(8(3)14)7(2)13(10)12-6/h4-5,8,14H,1-3H3/t8-/m0/s1
InChIKeyUZWQAQDOZRXXMO-QMMMGPOBSA-N
XLogP1.40
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol?
The IUPAC name of (1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol (CID 78930822) is (1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol.
What is the SMILES notation for (1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol?
The canonical SMILES for (1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol is Cc1cc2ncc([C@H](C)O)c(C)n2n1.
What is the InChIKey of (1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol?
The InChIKey is UZWQAQDOZRXXMO-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H13N3O/c1-6-4-10-11-5-9(8(3)14)7(2)13(10)12-6/h4-5,8,14H,1-3H3/t8-/m0/s1.
What are the key properties of (1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol?
(1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol has a molecular weight of 191.23 g/mol, XLogP of 1.40, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)ethanol is sourced from PubChem (CID 78930822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).