5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine

C17H23N5 — CID 95819538

IUPAC5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine
SMILESCC(C)N1CCC(c2cncc(-c3ccc(N)nc3)n2)CC1
InChIInChI=1S/C17H23N5/c1-12(2)22-7-5-13(6-8-22)15-10-19-11-16(21-15)14-3-4-17(18)20-9-14/h3-4,9-13H,5-8H2,1-2H3,(H2,18,20)
InChIKeyMPQUCYZUEYAHKL-UHFFFAOYSA-N
MW297.41 g/mol
LogP2.71
Rot. Bonds3

About 5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine

5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine (PubChem CID 95819538) has the molecular formula C17H23N5 and a molecular weight of 297.41 g/mol. Its IUPAC name is 5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine.

Molecular Properties

Compound Name5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine
PubChem CID95819538
Molecular FormulaC17H23N5
Molecular Weight297.41 g/mol
Exact Mass297.20
IUPAC Name5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine
SMILESCC(C)N1CCC(c2cncc(-c3ccc(N)nc3)n2)CC1
InChIInChI=1S/C17H23N5/c1-12(2)22-7-5-13(6-8-22)15-10-19-11-16(21-15)14-3-4-17(18)20-9-14/h3-4,9-13H,5-8H2,1-2H3,(H2,18,20)
InChIKeyMPQUCYZUEYAHKL-UHFFFAOYSA-N
XLogP2.71
TPSA67.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.41
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine?
The IUPAC name of 5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine (CID 95819538) is 5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine.
What is the SMILES notation for 5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine?
The canonical SMILES for 5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine is CC(C)N1CCC(c2cncc(-c3ccc(N)nc3)n2)CC1.
What is the InChIKey of 5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine?
The InChIKey is MPQUCYZUEYAHKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5/c1-12(2)22-7-5-13(6-8-22)15-10-19-11-16(21-15)14-3-4-17(18)20-9-14/h3-4,9-13H,5-8H2,1-2H3,(H2,18,20).
What are the key properties of 5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine?
5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine has a molecular weight of 297.41 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-(1-propan-2-ylpiperidin-4-yl)pyrazin-2-yl]pyridin-2-amine is sourced from PubChem (CID 95819538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).