[4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol

C12H20N4O2 — CID 81218197

IUPAC[4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol
SMILESCCNc1cc(N2CCOC(CO)C2)nc(C)n1
InChIInChI=1S/C12H20N4O2/c1-3-13-11-6-12(15-9(2)14-11)16-4-5-18-10(7-16)8-17/h6,10,17H,3-5,7-8H2,1-2H3,(H,13,14,15)
InChIKeyZWIKJCRVCQLWMO-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.41
Rot. Bonds4

About [4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol

[4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol (PubChem CID 81218197) has the molecular formula C12H20N4O2 and a molecular weight of 252.32 g/mol. Its IUPAC name is [4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol
PubChem CID81218197
Molecular FormulaC12H20N4O2
Molecular Weight252.32 g/mol
Exact Mass252.16
IUPAC Name[4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol
SMILESCCNc1cc(N2CCOC(CO)C2)nc(C)n1
InChIInChI=1S/C12H20N4O2/c1-3-13-11-6-12(15-9(2)14-11)16-4-5-18-10(7-16)8-17/h6,10,17H,3-5,7-8H2,1-2H3,(H,13,14,15)
InChIKeyZWIKJCRVCQLWMO-UHFFFAOYSA-N
XLogP0.41
TPSA70.51 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol?
The IUPAC name of [4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol (CID 81218197) is [4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol.
What is the SMILES notation for [4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol?
The canonical SMILES for [4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol is CCNc1cc(N2CCOC(CO)C2)nc(C)n1.
What is the InChIKey of [4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol?
The InChIKey is ZWIKJCRVCQLWMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2/c1-3-13-11-6-12(15-9(2)14-11)16-4-5-18-10(7-16)8-17/h6,10,17H,3-5,7-8H2,1-2H3,(H,13,14,15).
What are the key properties of [4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol?
[4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol has a molecular weight of 252.32 g/mol, XLogP of 0.41, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[6-(ethylamino)-2-methylpyrimidin-4-yl]morpholin-2-yl]methanol is sourced from PubChem (CID 81218197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).