6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine

C9H11ClFN3 — CID 130695773

IUPAC6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine
SMILESFC1(CNc2cncc(Cl)n2)CCC1
InChIInChI=1S/C9H11ClFN3/c10-7-4-12-5-8(14-7)13-6-9(11)2-1-3-9/h4-5H,1-3,6H2,(H,13,14)
InChIKeyJCOZEYXYYQDFRI-UHFFFAOYSA-N
MW215.66 g/mol
LogP2.43
Rot. Bonds3

About 6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine

6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine (PubChem CID 130695773) has the molecular formula C9H11ClFN3 and a molecular weight of 215.66 g/mol. Its IUPAC name is 6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine.

Molecular Properties

Compound Name6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine
PubChem CID130695773
Molecular FormulaC9H11ClFN3
Molecular Weight215.66 g/mol
Exact Mass215.06
IUPAC Name6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine
SMILESFC1(CNc2cncc(Cl)n2)CCC1
InChIInChI=1S/C9H11ClFN3/c10-7-4-12-5-8(14-7)13-6-9(11)2-1-3-9/h4-5H,1-3,6H2,(H,13,14)
InChIKeyJCOZEYXYYQDFRI-UHFFFAOYSA-N
XLogP2.43
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.66
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine?
The IUPAC name of 6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine (CID 130695773) is 6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine.
What is the SMILES notation for 6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine?
The canonical SMILES for 6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine is FC1(CNc2cncc(Cl)n2)CCC1.
What is the InChIKey of 6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine?
The InChIKey is JCOZEYXYYQDFRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClFN3/c10-7-4-12-5-8(14-7)13-6-9(11)2-1-3-9/h4-5H,1-3,6H2,(H,13,14).
What are the key properties of 6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine?
6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine has a molecular weight of 215.66 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[(1-fluorocyclobutyl)methyl]pyrazin-2-amine is sourced from PubChem (CID 130695773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).