4-cyclobutyloxyquinazolin-2-amine

C12H13N3O — CID 80873380

IUPAC4-cyclobutyloxyquinazolin-2-amine
SMILESNc1nc(OC2CCC2)c2ccccc2n1
InChIInChI=1S/C12H13N3O/c13-12-14-10-7-2-1-6-9(10)11(15-12)16-8-4-3-5-8/h1-2,6-8H,3-5H2,(H2,13,14,15)
InChIKeyIQYBAPWPTHFONJ-UHFFFAOYSA-N
MW215.26 g/mol
LogP2.14
Rot. Bonds2

About 4-cyclobutyloxyquinazolin-2-amine

4-cyclobutyloxyquinazolin-2-amine (PubChem CID 80873380) has the molecular formula C12H13N3O and a molecular weight of 215.26 g/mol. Its IUPAC name is 4-cyclobutyloxyquinazolin-2-amine.

Molecular Properties

Compound Name4-cyclobutyloxyquinazolin-2-amine
PubChem CID80873380
Molecular FormulaC12H13N3O
Molecular Weight215.26 g/mol
Exact Mass215.11
IUPAC Name4-cyclobutyloxyquinazolin-2-amine
SMILESNc1nc(OC2CCC2)c2ccccc2n1
InChIInChI=1S/C12H13N3O/c13-12-14-10-7-2-1-6-9(10)11(15-12)16-8-4-3-5-8/h1-2,6-8H,3-5H2,(H2,13,14,15)
InChIKeyIQYBAPWPTHFONJ-UHFFFAOYSA-N
XLogP2.14
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4,4-dimethylcyclohexyl)oxyquinazolin-2-amine
CID 114342927
4-(oxolan-3-yloxy)quinazolin-2-amine
CID 80876588
4-(cyclopropylmethoxy)quinazolin-2-amine
CID 80866857
4-cyclopentyloxyquinazoline-2-carboxylic acid
CID 55251807
4-(oxan-4-ylmethoxy)quinazolin-2-amine
CID 80880152
4-(oxolan-3-ylmethoxy)quinazolin-2-amine
CID 80873939
4-cyclohexylquinazolin-2-amine
CID 66520631
(1-cyclobutyloxyisoquinolin-3-yl)methanamine
CID 62286989
4-(1,1,1-trifluoropropan-2-yloxy)quinazolin-2-amine
CID 80878281
4-N-cyclooctylquinazoline-2,4-diamine
CID 80786546
4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)quinazolin-2-amine
CID 102723646
4-cyclobutyloxyquinolin-3-amine
CID 103963709

Frequently Asked Questions

What is the IUPAC name of 4-cyclobutyloxyquinazolin-2-amine?
The IUPAC name of 4-cyclobutyloxyquinazolin-2-amine (CID 80873380) is 4-cyclobutyloxyquinazolin-2-amine.
What is the SMILES notation for 4-cyclobutyloxyquinazolin-2-amine?
The canonical SMILES for 4-cyclobutyloxyquinazolin-2-amine is Nc1nc(OC2CCC2)c2ccccc2n1.
What is the InChIKey of 4-cyclobutyloxyquinazolin-2-amine?
The InChIKey is IQYBAPWPTHFONJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O/c13-12-14-10-7-2-1-6-9(10)11(15-12)16-8-4-3-5-8/h1-2,6-8H,3-5H2,(H2,13,14,15).
What are the key properties of 4-cyclobutyloxyquinazolin-2-amine?
4-cyclobutyloxyquinazolin-2-amine has a molecular weight of 215.26 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclobutyloxyquinazolin-2-amine is sourced from PubChem (CID 80873380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).