4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine

C19H18N6 — CID 56867973

IUPAC4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine
SMILESCc1ccc(-c2ccnc(NCc3cnn4ccccc34)n2)c(C)n1
InChIInChI=1S/C19H18N6/c1-13-6-7-16(14(2)23-13)17-8-9-20-19(24-17)21-11-15-12-22-25-10-4-3-5-18(15)25/h3-10,12H,11H2,1-2H3,(H,20,21,24)
InChIKeyZRBVCZXYBPXKJO-UHFFFAOYSA-N
MW330.40 g/mol
LogP3.42
Rot. Bonds4

About 4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine

4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine (PubChem CID 56867973) has the molecular formula C19H18N6 and a molecular weight of 330.40 g/mol. Its IUPAC name is 4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine
PubChem CID56867973
Molecular FormulaC19H18N6
Molecular Weight330.40 g/mol
Exact Mass330.16
IUPAC Name4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine
SMILESCc1ccc(-c2ccnc(NCc3cnn4ccccc34)n2)c(C)n1
InChIInChI=1S/C19H18N6/c1-13-6-7-16(14(2)23-13)17-8-9-20-19(24-17)21-11-15-12-22-25-10-4-3-5-18(15)25/h3-10,12H,11H2,1-2H3,(H,20,21,24)
InChIKeyZRBVCZXYBPXKJO-UHFFFAOYSA-N
XLogP3.42
TPSA68.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.40
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine?
The IUPAC name of 4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine (CID 56867973) is 4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine.
What is the SMILES notation for 4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine?
The canonical SMILES for 4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine is Cc1ccc(-c2ccnc(NCc3cnn4ccccc34)n2)c(C)n1.
What is the InChIKey of 4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine?
The InChIKey is ZRBVCZXYBPXKJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N6/c1-13-6-7-16(14(2)23-13)17-8-9-20-19(24-17)21-11-15-12-22-25-10-4-3-5-18(15)25/h3-10,12H,11H2,1-2H3,(H,20,21,24).
What are the key properties of 4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine?
4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine has a molecular weight of 330.40 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dimethyl-3-pyridinyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pyrimidin-2-amine is sourced from PubChem (CID 56867973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).