1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone

C14H18N6O2 — CID 110271881

IUPAC1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone
SMILESCc1nc(N)cc(C2CN(C(=O)Cn3cccn3)CCO2)n1
InChIInChI=1S/C14H18N6O2/c1-10-17-11(7-13(15)18-10)12-8-19(5-6-22-12)14(21)9-20-4-2-3-16-20/h2-4,7,12H,5-6,8-9H2,1H3,(H2,15,17,18)
InChIKeyCYZMZFIFUPEBRA-UHFFFAOYSA-N
MW302.34 g/mol
LogP0.16
Rot. Bonds3

About 1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone

1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone (PubChem CID 110271881) has the molecular formula C14H18N6O2 and a molecular weight of 302.34 g/mol. Its IUPAC name is 1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone.

Molecular Properties

Compound Name1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone
PubChem CID110271881
Molecular FormulaC14H18N6O2
Molecular Weight302.34 g/mol
Exact Mass302.15
IUPAC Name1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone
SMILESCc1nc(N)cc(C2CN(C(=O)Cn3cccn3)CCO2)n1
InChIInChI=1S/C14H18N6O2/c1-10-17-11(7-13(15)18-10)12-8-19(5-6-22-12)14(21)9-20-4-2-3-16-20/h2-4,7,12H,5-6,8-9H2,1H3,(H2,15,17,18)
InChIKeyCYZMZFIFUPEBRA-UHFFFAOYSA-N
XLogP0.16
TPSA99.16 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

[(2S)-2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-phenylmethanone
CID 95847585
1-[2-(1-aminoethyl)morpholin-4-yl]-2-pyrazol-1-ylethanone
CID 81483915
2-[(2R)-4-(2-pyrazol-1-ylacetyl)morpholin-2-yl]-N-(1,3-thiazol-2-yl)quinoline-4-carboxamide
CID 92638980
1-[(2S)-2-benzylmorpholin-4-yl]-2-pyrazol-1-ylethanone
CID 42508590
1-[2-(2,6-dimethylpyrimidin-4-yl)morpholin-4-yl]-3-(3-methylpyrazol-1-yl)propan-1-one
CID 110115964
1-[(2R)-2-isoquinolin-3-ylmorpholin-4-yl]-3-pyrazol-1-ylpropan-1-one
CID 92576978
1-[(2S)-2-(2,6-dimethylpyrimidin-4-yl)morpholin-4-yl]-3-(3-methylpyrazol-1-yl)propan-1-one
CID 124945971
1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-(2-methylbenzimidazol-1-yl)ethanone
CID 125019995
1-[4-(7-methylpyrazolo[1,5-a]pyrimidin-5-yl)piperidin-1-yl]-2-pyrazol-1-ylethanone
CID 110132835
6-[(2R)-4-cyclohexylmorpholin-2-yl]-2-methylpyrimidin-4-amine
CID 95847530
1-[(2R)-2-(6-fluoroisoquinolin-3-yl)morpholin-4-yl]-3-pyrazol-1-ylpropan-1-one
CID 92578316
1-[(2R)-2-(2,6-dimethylpyrimidin-4-yl)morpholin-4-yl]-3-(2-fluorophenyl)propan-1-one
CID 125017373

Frequently Asked Questions

What is the IUPAC name of 1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone?
The IUPAC name of 1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone (CID 110271881) is 1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone.
What is the SMILES notation for 1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone?
The canonical SMILES for 1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone is Cc1nc(N)cc(C2CN(C(=O)Cn3cccn3)CCO2)n1.
What is the InChIKey of 1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone?
The InChIKey is CYZMZFIFUPEBRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6O2/c1-10-17-11(7-13(15)18-10)12-8-19(5-6-22-12)14(21)9-20-4-2-3-16-20/h2-4,7,12H,5-6,8-9H2,1H3,(H2,15,17,18).
What are the key properties of 1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone?
1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone has a molecular weight of 302.34 g/mol, XLogP of 0.16, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(6-amino-2-methylpyrimidin-4-yl)morpholin-4-yl]-2-pyrazol-1-ylethanone is sourced from PubChem (CID 110271881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).