5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine

C18H19N7O2 — CID 177378950

IUPAC5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine
SMILESCCn1cc(-c2c(N)nn3ccc(-c4cnc(OC)c(OC)c4)nc23)cn1
InChIInChI=1S/C18H19N7O2/c1-4-24-10-12(9-21-24)15-16(19)23-25-6-5-13(22-17(15)25)11-7-14(26-2)18(27-3)20-8-11/h5-10H,4H2,1-3H3,(H2,19,23)
InChIKeyLXRDGUUSPQVOOO-UHFFFAOYSA-N
MW365.40 g/mol
LogP2.27
Rot. Bonds5

About 5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine

5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine (PubChem CID 177378950) has the molecular formula C18H19N7O2 and a molecular weight of 365.40 g/mol. Its IUPAC name is 5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine.

Molecular Properties

Compound Name5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine
PubChem CID177378950
Molecular FormulaC18H19N7O2
Molecular Weight365.40 g/mol
Exact Mass365.16
IUPAC Name5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine
SMILESCCn1cc(-c2c(N)nn3ccc(-c4cnc(OC)c(OC)c4)nc23)cn1
InChIInChI=1S/C18H19N7O2/c1-4-24-10-12(9-21-24)15-16(19)23-25-6-5-13(22-17(15)25)11-7-14(26-2)18(27-3)20-8-11/h5-10H,4H2,1-3H3,(H2,19,23)
InChIKeyLXRDGUUSPQVOOO-UHFFFAOYSA-N
XLogP2.27
TPSA105.38 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.40
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Related Compounds

5-(5,6-dimethoxy-3-pyridinyl)-3-(1-propan-2-ylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine
CID 177378951
2-(5,6-dimethoxy-3-pyridinyl)-6-(1-ethylpyrazol-4-yl)pyrrolo[3,4-b]pyridin-5-ol
CID 137099852
3-[5-(5-amino-6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-3-yl]prop-2-yn-1-ol
CID 123166237
2-(5,6-dimethoxy-3-pyridinyl)-6-[1-[(1-methylpyrazol-3-yl)methyl]pyrazol-4-yl]pyrrolo[3,4-b]pyridin-5-ol
CID 137117830
2-(5,6-dimethoxy-3-pyridinyl)-6-[1-[2-(3,5-dimethylpyrazol-1-yl)ethyl]pyrazol-4-yl]pyrrolo[3,4-b]pyridin-5-ol
CID 137095258
3-[4-[2-(5,6-dimethoxy-3-pyridinyl)-5-oxo-7H-pyrrolo[3,4-b]pyridin-6-yl]pyrazol-1-yl]propanenitrile
CID 53327579
2-(5,6-dimethoxy-3-pyridinyl)-6-[1-[2-(1,2,4-triazol-1-yl)ethyl]pyrazol-4-yl]pyrrolo[3,4-b]pyridin-5-ol
CID 137128343
2-(5,6-dimethoxy-3-pyridinyl)-7-ethoxy-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]pyrrolo[3,4-b]pyridin-5-ol
CID 137117667
5-(2-amino-3-propan-2-ylpyrazolo[1,5-a]pyrimidin-5-yl)-N-ethyl-N-(2-hydroxyethyl)-2-methoxybenzamide
CID 178179248
2-(5,6-dimethoxy-3-pyridinyl)-7-methyl-6-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-7H-pyrrolo[3,4-b]pyridin-5-one
CID 66743331
7-butyl-2-(6-ethoxy-5-methoxy-3-pyridinyl)-6-(1-ethylpyrazol-4-yl)-4-methyl-7H-pyrrolo[3,4-b]pyridin-5-one
CID 131995240
2-(5,6-dimethoxy-3-pyridinyl)-7-methyl-6-(1H-pyrazol-5-yl)pyrrolo[3,4-b]pyridin-5-ol
CID 137127088

Frequently Asked Questions

What is the IUPAC name of 5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine?
The IUPAC name of 5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine (CID 177378950) is 5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine.
What is the SMILES notation for 5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine?
The canonical SMILES for 5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine is CCn1cc(-c2c(N)nn3ccc(-c4cnc(OC)c(OC)c4)nc23)cn1.
What is the InChIKey of 5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine?
The InChIKey is LXRDGUUSPQVOOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N7O2/c1-4-24-10-12(9-21-24)15-16(19)23-25-6-5-13(22-17(15)25)11-7-14(26-2)18(27-3)20-8-11/h5-10H,4H2,1-3H3,(H2,19,23).
What are the key properties of 5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine?
5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine has a molecular weight of 365.40 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5,6-dimethoxy-3-pyridinyl)-3-(1-ethylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine is sourced from PubChem (CID 177378950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).