4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine

C11H14N6O — CID 50982860

IUPAC4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine
SMILESNc1nc(-c2ccn[nH]2)cc(N2CCOCC2)n1
InChIInChI=1S/C11H14N6O/c12-11-14-9(8-1-2-13-16-8)7-10(15-11)17-3-5-18-6-4-17/h1-2,7H,3-6H2,(H,13,16)(H2,12,14,15)
InChIKeyRZVYSELXDRVOEJ-UHFFFAOYSA-N
MW246.27 g/mol
LogP0.29
Rot. Bonds2

About 4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine

4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine (PubChem CID 50982860) has the molecular formula C11H14N6O and a molecular weight of 246.27 g/mol. Its IUPAC name is 4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine
PubChem CID50982860
Molecular FormulaC11H14N6O
Molecular Weight246.27 g/mol
Exact Mass246.12
IUPAC Name4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine
SMILESNc1nc(-c2ccn[nH]2)cc(N2CCOCC2)n1
InChIInChI=1S/C11H14N6O/c12-11-14-9(8-1-2-13-16-8)7-10(15-11)17-3-5-18-6-4-17/h1-2,7H,3-6H2,(H,13,16)(H2,12,14,15)
InChIKeyRZVYSELXDRVOEJ-UHFFFAOYSA-N
XLogP0.29
TPSA92.95 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine?
The IUPAC name of 4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine (CID 50982860) is 4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine?
The canonical SMILES for 4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine is Nc1nc(-c2ccn[nH]2)cc(N2CCOCC2)n1.
What is the InChIKey of 4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine?
The InChIKey is RZVYSELXDRVOEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6O/c12-11-14-9(8-1-2-13-16-8)7-10(15-11)17-3-5-18-6-4-17/h1-2,7H,3-6H2,(H,13,16)(H2,12,14,15).
What are the key properties of 4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine?
4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine has a molecular weight of 246.27 g/mol, XLogP of 0.29, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-yl-6-(1H-pyrazol-5-yl)pyrimidin-2-amine is sourced from PubChem (CID 50982860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).