1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride

C8H12ClN3 — CID 146050312

IUPAC1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride
SMILESCl.NC1(c2cnccn2)CCC1
InChIInChI=1S/C8H11N3.ClH/c9-8(2-1-3-8)7-6-10-4-5-11-7;/h4-6H,1-3,9H2;1H
InChIKeyWGPGCEPCSPXNBD-UHFFFAOYSA-N
MW185.66 g/mol
LogP1.24
Rot. Bonds1

About 1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride

1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride (PubChem CID 146050312) has the molecular formula C8H12ClN3 and a molecular weight of 185.66 g/mol. Its IUPAC name is 1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride.

Molecular Properties

Compound Name1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride
PubChem CID146050312
Molecular FormulaC8H12ClN3
Molecular Weight185.66 g/mol
Exact Mass185.07
IUPAC Name1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride
SMILESCl.NC1(c2cnccn2)CCC1
InChIInChI=1S/C8H11N3.ClH/c9-8(2-1-3-8)7-6-10-4-5-11-7;/h4-6H,1-3,9H2;1H
InChIKeyWGPGCEPCSPXNBD-UHFFFAOYSA-N
XLogP1.24
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.66
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride?
The IUPAC name of 1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride (CID 146050312) is 1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride.
What is the SMILES notation for 1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride?
The canonical SMILES for 1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride is Cl.NC1(c2cnccn2)CCC1.
What is the InChIKey of 1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride?
The InChIKey is WGPGCEPCSPXNBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3.ClH/c9-8(2-1-3-8)7-6-10-4-5-11-7;/h4-6H,1-3,9H2;1H.
What are the key properties of 1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride?
1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride has a molecular weight of 185.66 g/mol, XLogP of 1.24, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrazin-2-ylcyclobutan-1-amine;hydrochloride is sourced from PubChem (CID 146050312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).