6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine

C21H16N8 — CID 167366670

IUPAC6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine
SMILESCc1cccc(-c2[nH]ncc2-c2ccc3ncc(-c4cncc(N)n4)cc3n2)n1
InChIInChI=1S/C21H16N8/c1-12-3-2-4-17(26-12)21-14(9-25-29-21)15-5-6-16-18(27-15)7-13(8-24-16)19-10-23-11-20(22)28-19/h2-11H,1H3,(H2,22,28)(H,25,29)
InChIKeySPUQVXWCXYUDPP-UHFFFAOYSA-N
MW380.42 g/mol
LogP3.43
Rot. Bonds3

About 6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine

6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine (PubChem CID 167366670) has the molecular formula C21H16N8 and a molecular weight of 380.42 g/mol. Its IUPAC name is 6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine.

Molecular Properties

Compound Name6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine
PubChem CID167366670
Molecular FormulaC21H16N8
Molecular Weight380.42 g/mol
Exact Mass380.15
IUPAC Name6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine
SMILESCc1cccc(-c2[nH]ncc2-c2ccc3ncc(-c4cncc(N)n4)cc3n2)n1
InChIInChI=1S/C21H16N8/c1-12-3-2-4-17(26-12)21-14(9-25-29-21)15-5-6-16-18(27-15)7-13(8-24-16)19-10-23-11-20(22)28-19/h2-11H,1H3,(H2,22,28)(H,25,29)
InChIKeySPUQVXWCXYUDPP-UHFFFAOYSA-N
XLogP3.43
TPSA119.15 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.42
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine?
The IUPAC name of 6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine (CID 167366670) is 6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine.
What is the SMILES notation for 6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine?
The canonical SMILES for 6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine is Cc1cccc(-c2[nH]ncc2-c2ccc3ncc(-c4cncc(N)n4)cc3n2)n1.
What is the InChIKey of 6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine?
The InChIKey is SPUQVXWCXYUDPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N8/c1-12-3-2-4-17(26-12)21-14(9-25-29-21)15-5-6-16-18(27-15)7-13(8-24-16)19-10-23-11-20(22)28-19/h2-11H,1H3,(H2,22,28)(H,25,29).
What are the key properties of 6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine?
6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine has a molecular weight of 380.42 g/mol, XLogP of 3.43, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine is sourced from PubChem (CID 167366670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).