5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine

C22H21N5 — CID 165033373

IUPAC5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cncc(-c2cc(NC3CCc4ccccc4C3)n3nccc3n2)c1
InChIInChI=1S/C22H21N5/c1-15-10-18(14-23-13-15)20-12-22(27-21(26-20)8-9-24-27)25-19-7-6-16-4-2-3-5-17(16)11-19/h2-5,8-10,12-14,19,25H,6-7,11H2,1H3
InChIKeyDLXMWNJSPUCJHS-UHFFFAOYSA-N
MW355.45 g/mol
LogP4.07
Rot. Bonds3

About 5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine

5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 165033373) has the molecular formula C22H21N5 and a molecular weight of 355.45 g/mol. Its IUPAC name is 5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID165033373
Molecular FormulaC22H21N5
Molecular Weight355.45 g/mol
Exact Mass355.18
IUPAC Name5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cncc(-c2cc(NC3CCc4ccccc4C3)n3nccc3n2)c1
InChIInChI=1S/C22H21N5/c1-15-10-18(14-23-13-15)20-12-22(27-21(26-20)8-9-24-27)25-19-7-6-16-4-2-3-5-17(16)11-19/h2-5,8-10,12-14,19,25H,6-7,11H2,1H3
InChIKeyDLXMWNJSPUCJHS-UHFFFAOYSA-N
XLogP4.07
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.45
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 165033373) is 5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine is Cc1cncc(-c2cc(NC3CCc4ccccc4C3)n3nccc3n2)c1.
What is the InChIKey of 5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is DLXMWNJSPUCJHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N5/c1-15-10-18(14-23-13-15)20-12-22(27-21(26-20)8-9-24-27)25-19-7-6-16-4-2-3-5-17(16)11-19/h2-5,8-10,12-14,19,25H,6-7,11H2,1H3.
What are the key properties of 5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine?
5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 355.45 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methyl-3-pyridinyl)-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 165033373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).