3-quinazolin-2-ylcyclobutan-1-amine

C12H13N3 — CID 155173666

IUPAC3-quinazolin-2-ylcyclobutan-1-amine
SMILESNC1CC(c2ncc3ccccc3n2)C1
InChIInChI=1S/C12H13N3/c13-10-5-9(6-10)12-14-7-8-3-1-2-4-11(8)15-12/h1-4,7,9-10H,5-6,13H2
InChIKeyAMUMLZQTJUQMGZ-UHFFFAOYSA-N
MW199.26 g/mol
LogP1.83
Rot. Bonds1

About 3-quinazolin-2-ylcyclobutan-1-amine

3-quinazolin-2-ylcyclobutan-1-amine (PubChem CID 155173666) has the molecular formula C12H13N3 and a molecular weight of 199.26 g/mol. Its IUPAC name is 3-quinazolin-2-ylcyclobutan-1-amine.

Molecular Properties

Compound Name3-quinazolin-2-ylcyclobutan-1-amine
PubChem CID155173666
Molecular FormulaC12H13N3
Molecular Weight199.26 g/mol
Exact Mass199.11
IUPAC Name3-quinazolin-2-ylcyclobutan-1-amine
SMILESNC1CC(c2ncc3ccccc3n2)C1
InChIInChI=1S/C12H13N3/c13-10-5-9(6-10)12-14-7-8-3-1-2-4-11(8)15-12/h1-4,7,9-10H,5-6,13H2
InChIKeyAMUMLZQTJUQMGZ-UHFFFAOYSA-N
XLogP1.83
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.26
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-quinazolin-2-ylcyclobutan-1-amine?
The IUPAC name of 3-quinazolin-2-ylcyclobutan-1-amine (CID 155173666) is 3-quinazolin-2-ylcyclobutan-1-amine.
What is the SMILES notation for 3-quinazolin-2-ylcyclobutan-1-amine?
The canonical SMILES for 3-quinazolin-2-ylcyclobutan-1-amine is NC1CC(c2ncc3ccccc3n2)C1.
What is the InChIKey of 3-quinazolin-2-ylcyclobutan-1-amine?
The InChIKey is AMUMLZQTJUQMGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3/c13-10-5-9(6-10)12-14-7-8-3-1-2-4-11(8)15-12/h1-4,7,9-10H,5-6,13H2.
What are the key properties of 3-quinazolin-2-ylcyclobutan-1-amine?
3-quinazolin-2-ylcyclobutan-1-amine has a molecular weight of 199.26 g/mol, XLogP of 1.83, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-quinazolin-2-ylcyclobutan-1-amine is sourced from PubChem (CID 155173666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).