4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine

C11H16N4O — CID 118974125

IUPAC4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine
SMILESCN1Cc2cnc(N3CCOCC3)nc2C1
InChIInChI=1S/C11H16N4O/c1-14-7-9-6-12-11(13-10(9)8-14)15-2-4-16-5-3-15/h6H,2-5,7-8H2,1H3
InChIKeyFLDCOZADERDNIY-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.26
Rot. Bonds1

About 4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine

4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine (PubChem CID 118974125) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine.

Molecular Properties

Compound Name4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine
PubChem CID118974125
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine
SMILESCN1Cc2cnc(N3CCOCC3)nc2C1
InChIInChI=1S/C11H16N4O/c1-14-7-9-6-12-11(13-10(9)8-14)15-2-4-16-5-3-15/h6H,2-5,7-8H2,1H3
InChIKeyFLDCOZADERDNIY-UHFFFAOYSA-N
XLogP0.26
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine?
The IUPAC name of 4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine (CID 118974125) is 4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine.
What is the SMILES notation for 4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine?
The canonical SMILES for 4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine is CN1Cc2cnc(N3CCOCC3)nc2C1.
What is the InChIKey of 4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine?
The InChIKey is FLDCOZADERDNIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-14-7-9-6-12-11(13-10(9)8-14)15-2-4-16-5-3-15/h6H,2-5,7-8H2,1H3.
What are the key properties of 4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine?
4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine has a molecular weight of 220.28 g/mol, XLogP of 0.26, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl)morpholine is sourced from PubChem (CID 118974125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).