2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine

C15H14N4O2 — CID 107315860

IUPAC2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine
SMILESCOCc1nc(N)cc(Oc2ccc3cccnc3c2)n1
InChIInChI=1S/C15H14N4O2/c1-20-9-14-18-13(16)8-15(19-14)21-11-5-4-10-3-2-6-17-12(10)7-11/h2-8H,9H2,1H3,(H2,16,18,19)
InChIKeyJDVJXYDQYQWTGQ-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.55
Rot. Bonds4

About 2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine

2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine (PubChem CID 107315860) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine
PubChem CID107315860
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine
SMILESCOCc1nc(N)cc(Oc2ccc3cccnc3c2)n1
InChIInChI=1S/C15H14N4O2/c1-20-9-14-18-13(16)8-15(19-14)21-11-5-4-10-3-2-6-17-12(10)7-11/h2-8H,9H2,1H3,(H2,16,18,19)
InChIKeyJDVJXYDQYQWTGQ-UHFFFAOYSA-N
XLogP2.55
TPSA83.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine?
The IUPAC name of 2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine (CID 107315860) is 2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine.
What is the SMILES notation for 2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine?
The canonical SMILES for 2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine is COCc1nc(N)cc(Oc2ccc3cccnc3c2)n1.
What is the InChIKey of 2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine?
The InChIKey is JDVJXYDQYQWTGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-20-9-14-18-13(16)8-15(19-14)21-11-5-4-10-3-2-6-17-12(10)7-11/h2-8H,9H2,1H3,(H2,16,18,19).
What are the key properties of 2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine?
2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine has a molecular weight of 282.30 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-6-quinolin-7-yloxypyrimidin-4-amine is sourced from PubChem (CID 107315860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).