6-chloro-N-propylpyrazin-2-amine

C7H10ClN3 — CID 26370207

IUPAC6-chloro-N-propylpyrazin-2-amine
SMILESCCCNc1cncc(Cl)n1
InChIInChI=1S/C7H10ClN3/c1-2-3-10-7-5-9-4-6(8)11-7/h4-5H,2-3H2,1H3,(H,10,11)
InChIKeyFTDDBUCCKNVIJZ-UHFFFAOYSA-N
MW171.63 g/mol
LogP1.95
Rot. Bonds3

About 6-chloro-N-propylpyrazin-2-amine

6-chloro-N-propylpyrazin-2-amine (PubChem CID 26370207) has the molecular formula C7H10ClN3 and a molecular weight of 171.63 g/mol. Its IUPAC name is 6-chloro-N-propylpyrazin-2-amine.

Molecular Properties

Compound Name6-chloro-N-propylpyrazin-2-amine
PubChem CID26370207
Molecular FormulaC7H10ClN3
Molecular Weight171.63 g/mol
Exact Mass171.06
IUPAC Name6-chloro-N-propylpyrazin-2-amine
SMILESCCCNc1cncc(Cl)n1
InChIInChI=1S/C7H10ClN3/c1-2-3-10-7-5-9-4-6(8)11-7/h4-5H,2-3H2,1H3,(H,10,11)
InChIKeyFTDDBUCCKNVIJZ-UHFFFAOYSA-N
XLogP1.95
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.63
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-propylpyrazin-2-amine?
The IUPAC name of 6-chloro-N-propylpyrazin-2-amine (CID 26370207) is 6-chloro-N-propylpyrazin-2-amine.
What is the SMILES notation for 6-chloro-N-propylpyrazin-2-amine?
The canonical SMILES for 6-chloro-N-propylpyrazin-2-amine is CCCNc1cncc(Cl)n1.
What is the InChIKey of 6-chloro-N-propylpyrazin-2-amine?
The InChIKey is FTDDBUCCKNVIJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN3/c1-2-3-10-7-5-9-4-6(8)11-7/h4-5H,2-3H2,1H3,(H,10,11).
What are the key properties of 6-chloro-N-propylpyrazin-2-amine?
6-chloro-N-propylpyrazin-2-amine has a molecular weight of 171.63 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-propylpyrazin-2-amine is sourced from PubChem (CID 26370207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).