N-(1-cyclobutylethyl)-5-methylquinazolin-4-amine

C15H19N3 — CID 133417844

IUPACN-(1-cyclobutylethyl)-5-methylquinazolin-4-amine
SMILESCc1cccc2ncnc(NC(C)C3CCC3)c12
InChIInChI=1S/C15H19N3/c1-10-5-3-8-13-14(10)15(17-9-16-13)18-11(2)12-6-4-7-12/h3,5,8-9,11-12H,4,6-7H2,1-2H3,(H,16,17,18)
InChIKeyBCQILXIXOLNNRK-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.54
Rot. Bonds3

About N-(1-cyclobutylethyl)-5-methylquinazolin-4-amine

N-(1-cyclobutylethyl)-5-methylquinazolin-4-amine (PubChem CID 133417844) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N-(1-cyclobutylethyl)-5-methylquinazolin-4-amine.

Molecular Properties

Compound NameN-(1-cyclobutylethyl)-5-methylquinazolin-4-amine
PubChem CID133417844
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN-(1-cyclobutylethyl)-5-methylquinazolin-4-amine
SMILESCc1cccc2ncnc(NC(C)C3CCC3)c12
InChIInChI=1S/C15H19N3/c1-10-5-3-8-13-14(10)15(17-9-16-13)18-11(2)12-6-4-7-12/h3,5,8-9,11-12H,4,6-7H2,1-2H3,(H,16,17,18)
InChIKeyBCQILXIXOLNNRK-UHFFFAOYSA-N
XLogP3.54
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclobutylethyl)-5-methylquinazolin-4-amine?
The IUPAC name of N-(1-cyclobutylethyl)-5-methylquinazolin-4-amine (CID 133417844) is N-(1-cyclobutylethyl)-5-methylquinazolin-4-amine.
What is the SMILES notation for N-(1-cyclobutylethyl)-5-methylquinazolin-4-amine?
The canonical SMILES for N-(1-cyclobutylethyl)-5-methylquinazolin-4-amine is Cc1cccc2ncnc(NC(C)C3CCC3)c12.
What is the InChIKey of N-(1-cyclobutylethyl)-5-methylquinazolin-4-amine?
The InChIKey is BCQILXIXOLNNRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-10-5-3-8-13-14(10)15(17-9-16-13)18-11(2)12-6-4-7-12/h3,5,8-9,11-12H,4,6-7H2,1-2H3,(H,16,17,18).
What are the key properties of N-(1-cyclobutylethyl)-5-methylquinazolin-4-amine?
N-(1-cyclobutylethyl)-5-methylquinazolin-4-amine has a molecular weight of 241.34 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclobutylethyl)-5-methylquinazolin-4-amine is sourced from PubChem (CID 133417844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).