4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine

C12H10N6 — CID 153277392

IUPAC4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine
SMILESNc1nccc(-c2cn[nH]c2-c2cccnc2)n1
InChIInChI=1S/C12H10N6/c13-12-15-5-3-10(17-12)9-7-16-18-11(9)8-2-1-4-14-6-8/h1-7H,(H,16,18)(H2,13,15,17)
InChIKeyAIVDSYDXMBZUOH-UHFFFAOYSA-N
MW238.25 g/mol
LogP1.51
Rot. Bonds2

About 4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine

4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine (PubChem CID 153277392) has the molecular formula C12H10N6 and a molecular weight of 238.25 g/mol. Its IUPAC name is 4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine
PubChem CID153277392
Molecular FormulaC12H10N6
Molecular Weight238.25 g/mol
Exact Mass238.10
IUPAC Name4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine
SMILESNc1nccc(-c2cn[nH]c2-c2cccnc2)n1
InChIInChI=1S/C12H10N6/c13-12-15-5-3-10(17-12)9-7-16-18-11(9)8-2-1-4-14-6-8/h1-7H,(H,16,18)(H2,13,15,17)
InChIKeyAIVDSYDXMBZUOH-UHFFFAOYSA-N
XLogP1.51
TPSA93.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-pyridin-4-yl-1H-pyrazol-5-yl)pyridine
CID 3321413
4-(5-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine
CID 129206992
5-pyridin-3-ylpyrimidine-2,4-diamine
CID 118493821
2-chloro-4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]pyrimidine
CID 22037213
4-pyridin-2-yl-5-pyridin-3-yl-1H-pyrazol-3-amine
CID 80521247
N-[4-[1-(2-methoxyethyl)piperidin-4-yl]phenyl]-4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine
CID 142395558
4-(6-pyridin-3-ylimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine
CID 175733041
4-(4-chloro-3-pyridinyl)pyrimidin-2-amine
CID 130049220
(5-pyridin-3-yl-1H-pyrazol-4-yl)methanol
CID 43753528
4-[4-(2-bromoethyl)-1H-pyrazol-5-yl]pyrimidin-2-amine
CID 123868830
(E)-N-methoxy-1-(5-pyridin-3-yl-1H-pyrazol-4-yl)methanimine
CID 167935057
4-(1H-indazol-5-yl)pyrimidin-2-amine
CID 54420708

Frequently Asked Questions

What is the IUPAC name of 4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine?
The IUPAC name of 4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine (CID 153277392) is 4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine?
The canonical SMILES for 4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine is Nc1nccc(-c2cn[nH]c2-c2cccnc2)n1.
What is the InChIKey of 4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine?
The InChIKey is AIVDSYDXMBZUOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N6/c13-12-15-5-3-10(17-12)9-7-16-18-11(9)8-2-1-4-14-6-8/h1-7H,(H,16,18)(H2,13,15,17).
What are the key properties of 4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine?
4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine has a molecular weight of 238.25 g/mol, XLogP of 1.51, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-pyridin-3-yl-1H-pyrazol-4-yl)pyrimidin-2-amine is sourced from PubChem (CID 153277392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).