5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine

C10H17N5 — CID 67362960

IUPAC5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine
SMILESCN1CCC(c2cnc(N)c(N)n2)CC1
InChIInChI=1S/C10H17N5/c1-15-4-2-7(3-5-15)8-6-13-9(11)10(12)14-8/h6-7H,2-5H2,1H3,(H2,11,13)(H2,12,14)
InChIKeySZGQPGXWYILBQN-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.45
Rot. Bonds1

About 5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine

5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine (PubChem CID 67362960) has the molecular formula C10H17N5 and a molecular weight of 207.28 g/mol. Its IUPAC name is 5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine.

Molecular Properties

Compound Name5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine
PubChem CID67362960
Molecular FormulaC10H17N5
Molecular Weight207.28 g/mol
Exact Mass207.15
IUPAC Name5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine
SMILESCN1CCC(c2cnc(N)c(N)n2)CC1
InChIInChI=1S/C10H17N5/c1-15-4-2-7(3-5-15)8-6-13-9(11)10(12)14-8/h6-7H,2-5H2,1H3,(H2,11,13)(H2,12,14)
InChIKeySZGQPGXWYILBQN-UHFFFAOYSA-N
XLogP0.45
TPSA81.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine?
The IUPAC name of 5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine (CID 67362960) is 5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine.
What is the SMILES notation for 5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine?
The canonical SMILES for 5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine is CN1CCC(c2cnc(N)c(N)n2)CC1.
What is the InChIKey of 5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine?
The InChIKey is SZGQPGXWYILBQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5/c1-15-4-2-7(3-5-15)8-6-13-9(11)10(12)14-8/h6-7H,2-5H2,1H3,(H2,11,13)(H2,12,14).
What are the key properties of 5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine?
5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine has a molecular weight of 207.28 g/mol, XLogP of 0.45, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylpiperidin-4-yl)pyrazine-2,3-diamine is sourced from PubChem (CID 67362960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).