3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine

C14H18N6 — CID 95821778

IUPAC3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine
SMILESCN1CCC(c2nccnc2Nc2cnccn2)CC1
InChIInChI=1S/C14H18N6/c1-20-8-2-11(3-9-20)13-14(18-7-6-17-13)19-12-10-15-4-5-16-12/h4-7,10-11H,2-3,8-9H2,1H3,(H,16,18,19)
InChIKeyGFSOHCKQDIRVCT-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.82
Rot. Bonds3

About 3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine

3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine (PubChem CID 95821778) has the molecular formula C14H18N6 and a molecular weight of 270.34 g/mol. Its IUPAC name is 3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine.

Molecular Properties

Compound Name3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine
PubChem CID95821778
Molecular FormulaC14H18N6
Molecular Weight270.34 g/mol
Exact Mass270.16
IUPAC Name3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine
SMILESCN1CCC(c2nccnc2Nc2cnccn2)CC1
InChIInChI=1S/C14H18N6/c1-20-8-2-11(3-9-20)13-14(18-7-6-17-13)19-12-10-15-4-5-16-12/h4-7,10-11H,2-3,8-9H2,1H3,(H,16,18,19)
InChIKeyGFSOHCKQDIRVCT-UHFFFAOYSA-N
XLogP1.82
TPSA66.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine?
The IUPAC name of 3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine (CID 95821778) is 3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine.
What is the SMILES notation for 3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine?
The canonical SMILES for 3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine is CN1CCC(c2nccnc2Nc2cnccn2)CC1.
What is the InChIKey of 3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine?
The InChIKey is GFSOHCKQDIRVCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6/c1-20-8-2-11(3-9-20)13-14(18-7-6-17-13)19-12-10-15-4-5-16-12/h4-7,10-11H,2-3,8-9H2,1H3,(H,16,18,19).
What are the key properties of 3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine?
3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine has a molecular weight of 270.34 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpiperidin-4-yl)-N-pyrazin-2-ylpyrazin-2-amine is sourced from PubChem (CID 95821778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).