4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine

C15H20N4O — CID 80787211

IUPAC4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine
SMILESCNc1nc(N2CC(C)OCC2C)c2ccccc2n1
InChIInChI=1S/C15H20N4O/c1-10-9-20-11(2)8-19(10)14-12-6-4-5-7-13(12)17-15(16-3)18-14/h4-7,10-11H,8-9H2,1-3H3,(H,16,17,18)
InChIKeyZAOIRXJQMQHPBS-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.29
Rot. Bonds2

About 4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine

4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine (PubChem CID 80787211) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine.

Molecular Properties

Compound Name4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine
PubChem CID80787211
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine
SMILESCNc1nc(N2CC(C)OCC2C)c2ccccc2n1
InChIInChI=1S/C15H20N4O/c1-10-9-20-11(2)8-19(10)14-12-6-4-5-7-13(12)17-15(16-3)18-14/h4-7,10-11H,8-9H2,1-3H3,(H,16,17,18)
InChIKeyZAOIRXJQMQHPBS-UHFFFAOYSA-N
XLogP2.29
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine?
The IUPAC name of 4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine (CID 80787211) is 4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine.
What is the SMILES notation for 4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine?
The canonical SMILES for 4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine is CNc1nc(N2CC(C)OCC2C)c2ccccc2n1.
What is the InChIKey of 4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine?
The InChIKey is ZAOIRXJQMQHPBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-10-9-20-11(2)8-19(10)14-12-6-4-5-7-13(12)17-15(16-3)18-14/h4-7,10-11H,8-9H2,1-3H3,(H,16,17,18).
What are the key properties of 4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine?
4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine has a molecular weight of 272.35 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethylmorpholin-4-yl)-N-methylquinazolin-2-amine is sourced from PubChem (CID 80787211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).