N-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine

C19H16N6O — CID 59374284

IUPACN-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine
SMILESCn1cc(-c2nccnc2Oc2ccc(Nc3ccccn3)cc2)cn1
InChIInChI=1S/C19H16N6O/c1-25-13-14(12-23-25)18-19(22-11-10-21-18)26-16-7-5-15(6-8-16)24-17-4-2-3-9-20-17/h2-13H,1H3,(H,20,24)
InChIKeyVKAAYQKQIWOSFC-UHFFFAOYSA-N
MW344.38 g/mol
LogP3.81
Rot. Bonds5

About N-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine

N-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine (PubChem CID 59374284) has the molecular formula C19H16N6O and a molecular weight of 344.38 g/mol. Its IUPAC name is N-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine
PubChem CID59374284
Molecular FormulaC19H16N6O
Molecular Weight344.38 g/mol
Exact Mass344.14
IUPAC NameN-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine
SMILESCn1cc(-c2nccnc2Oc2ccc(Nc3ccccn3)cc2)cn1
InChIInChI=1S/C19H16N6O/c1-25-13-14(12-23-25)18-19(22-11-10-21-18)26-16-7-5-15(6-8-16)24-17-4-2-3-9-20-17/h2-13H,1H3,(H,20,24)
InChIKeyVKAAYQKQIWOSFC-UHFFFAOYSA-N
XLogP3.81
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.38
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine?
The IUPAC name of N-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine (CID 59374284) is N-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine.
What is the SMILES notation for N-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine?
The canonical SMILES for N-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine is Cn1cc(-c2nccnc2Oc2ccc(Nc3ccccn3)cc2)cn1.
What is the InChIKey of N-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine?
The InChIKey is VKAAYQKQIWOSFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N6O/c1-25-13-14(12-23-25)18-19(22-11-10-21-18)26-16-7-5-15(6-8-16)24-17-4-2-3-9-20-17/h2-13H,1H3,(H,20,24).
What are the key properties of N-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine?
N-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine has a molecular weight of 344.38 g/mol, XLogP of 3.81, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]oxyphenyl]pyridin-2-amine is sourced from PubChem (CID 59374284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).