4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine

C10H13N5O — CID 653309

IUPAC4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine
SMILESCn1ncc2c(N3CCOCC3)ncnc21
InChIInChI=1S/C10H13N5O/c1-14-9-8(6-13-14)10(12-7-11-9)15-2-4-16-5-3-15/h6-7H,2-5H2,1H3
InChIKeyTUQCXANZABEVKM-UHFFFAOYSA-N
MW219.25 g/mol
LogP0.20
Rot. Bonds1

About 4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine

4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine (PubChem CID 653309) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is 4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine
PubChem CID653309
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC Name4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine
SMILESCn1ncc2c(N3CCOCC3)ncnc21
InChIInChI=1S/C10H13N5O/c1-14-9-8(6-13-14)10(12-7-11-9)15-2-4-16-5-3-15/h6-7H,2-5H2,1H3
InChIKeyTUQCXANZABEVKM-UHFFFAOYSA-N
XLogP0.20
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 50.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine?
The IUPAC name of 4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine (CID 653309) is 4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine.
What is the SMILES notation for 4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine?
The canonical SMILES for 4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine is Cn1ncc2c(N3CCOCC3)ncnc21.
What is the InChIKey of 4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine?
The InChIKey is TUQCXANZABEVKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c1-14-9-8(6-13-14)10(12-7-11-9)15-2-4-16-5-3-15/h6-7H,2-5H2,1H3.
What are the key properties of 4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine?
4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine has a molecular weight of 219.25 g/mol, XLogP of 0.20, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine is sourced from PubChem (CID 653309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).