N-pentan-2-ylpyrazin-2-amine

C9H15N3 — CID 43107057

IUPACN-pentan-2-ylpyrazin-2-amine
SMILESCCCC(C)Nc1cnccn1
InChIInChI=1S/C9H15N3/c1-3-4-8(2)12-9-7-10-5-6-11-9/h5-8H,3-4H2,1-2H3,(H,11,12)
InChIKeyUSBUHYURLQFIHI-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.08
Rot. Bonds4

About N-pentan-2-ylpyrazin-2-amine

N-pentan-2-ylpyrazin-2-amine (PubChem CID 43107057) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is N-pentan-2-ylpyrazin-2-amine.

Molecular Properties

Compound NameN-pentan-2-ylpyrazin-2-amine
PubChem CID43107057
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC NameN-pentan-2-ylpyrazin-2-amine
SMILESCCCC(C)Nc1cnccn1
InChIInChI=1S/C9H15N3/c1-3-4-8(2)12-9-7-10-5-6-11-9/h5-8H,3-4H2,1-2H3,(H,11,12)
InChIKeyUSBUHYURLQFIHI-UHFFFAOYSA-N
XLogP2.08
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-pentan-2-ylpyrazin-2-amine?
The IUPAC name of N-pentan-2-ylpyrazin-2-amine (CID 43107057) is N-pentan-2-ylpyrazin-2-amine.
What is the SMILES notation for N-pentan-2-ylpyrazin-2-amine?
The canonical SMILES for N-pentan-2-ylpyrazin-2-amine is CCCC(C)Nc1cnccn1.
What is the InChIKey of N-pentan-2-ylpyrazin-2-amine?
The InChIKey is USBUHYURLQFIHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-3-4-8(2)12-9-7-10-5-6-11-9/h5-8H,3-4H2,1-2H3,(H,11,12).
What are the key properties of N-pentan-2-ylpyrazin-2-amine?
N-pentan-2-ylpyrazin-2-amine has a molecular weight of 165.24 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-2-ylpyrazin-2-amine is sourced from PubChem (CID 43107057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).