8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine

C14H18N4O2 — CID 23157783

IUPAC8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine
SMILESCNc1ncc2c(N3CCOCC3)ccc(OC)c2n1
InChIInChI=1S/C14H18N4O2/c1-15-14-16-9-10-11(18-5-7-20-8-6-18)3-4-12(19-2)13(10)17-14/h3-4,9H,5-8H2,1-2H3,(H,15,16,17)
InChIKeySDQNAPYUVCZYDZ-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.52
Rot. Bonds3

About 8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine

8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine (PubChem CID 23157783) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine.

Molecular Properties

Compound Name8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine
PubChem CID23157783
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine
SMILESCNc1ncc2c(N3CCOCC3)ccc(OC)c2n1
InChIInChI=1S/C14H18N4O2/c1-15-14-16-9-10-11(18-5-7-20-8-6-18)3-4-12(19-2)13(10)17-14/h3-4,9H,5-8H2,1-2H3,(H,15,16,17)
InChIKeySDQNAPYUVCZYDZ-UHFFFAOYSA-N
XLogP1.52
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine?
The IUPAC name of 8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine (CID 23157783) is 8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine.
What is the SMILES notation for 8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine?
The canonical SMILES for 8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine is CNc1ncc2c(N3CCOCC3)ccc(OC)c2n1.
What is the InChIKey of 8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine?
The InChIKey is SDQNAPYUVCZYDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-15-14-16-9-10-11(18-5-7-20-8-6-18)3-4-12(19-2)13(10)17-14/h3-4,9H,5-8H2,1-2H3,(H,15,16,17).
What are the key properties of 8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine?
8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine has a molecular weight of 274.32 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-N-methyl-5-morpholin-4-ylquinazolin-2-amine is sourced from PubChem (CID 23157783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).