3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine

C20H19N5O3 — CID 59662582

IUPAC3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine
SMILESCOc1ccc(-c2cnn3ccc(Nc4ccc(OC)nc4)nc23)c(OC)c1
InChIInChI=1S/C20H19N5O3/c1-26-14-5-6-15(17(10-14)27-2)16-12-22-25-9-8-18(24-20(16)25)23-13-4-7-19(28-3)21-11-13/h4-12H,1-3H3,(H,23,24)
InChIKeyIYVZNIMLHQOWRT-UHFFFAOYSA-N
MW377.40 g/mol
LogP3.56
Rot. Bonds6

About 3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine

3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine (PubChem CID 59662582) has the molecular formula C20H19N5O3 and a molecular weight of 377.40 g/mol. Its IUPAC name is 3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine.

Molecular Properties

Compound Name3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine
PubChem CID59662582
Molecular FormulaC20H19N5O3
Molecular Weight377.40 g/mol
Exact Mass377.15
IUPAC Name3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine
SMILESCOc1ccc(-c2cnn3ccc(Nc4ccc(OC)nc4)nc23)c(OC)c1
InChIInChI=1S/C20H19N5O3/c1-26-14-5-6-15(17(10-14)27-2)16-12-22-25-9-8-18(24-20(16)25)23-13-4-7-19(28-3)21-11-13/h4-12H,1-3H3,(H,23,24)
InChIKeyIYVZNIMLHQOWRT-UHFFFAOYSA-N
XLogP3.56
TPSA82.80 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.40
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine?
The IUPAC name of 3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine (CID 59662582) is 3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine.
What is the SMILES notation for 3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine?
The canonical SMILES for 3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine is COc1ccc(-c2cnn3ccc(Nc4ccc(OC)nc4)nc23)c(OC)c1.
What is the InChIKey of 3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine?
The InChIKey is IYVZNIMLHQOWRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O3/c1-26-14-5-6-15(17(10-14)27-2)16-12-22-25-9-8-18(24-20(16)25)23-13-4-7-19(28-3)21-11-13/h4-12H,1-3H3,(H,23,24).
What are the key properties of 3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine?
3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine has a molecular weight of 377.40 g/mol, XLogP of 3.56, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dimethoxyphenyl)-N-(6-methoxy-3-pyridinyl)pyrazolo[1,5-a]pyrimidin-5-amine is sourced from PubChem (CID 59662582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).