4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine

C11H18N4O — CID 80795705

IUPAC4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine
SMILESCCC1COC(C)CN1c1ccnc(N)n1
InChIInChI=1S/C11H18N4O/c1-3-9-7-16-8(2)6-15(9)10-4-5-13-11(12)14-10/h4-5,8-9H,3,6-7H2,1-2H3,(H2,12,13,14)
InChIKeyFTSYOUSLGGPFNW-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.06
Rot. Bonds2

About 4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine

4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine (PubChem CID 80795705) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine
PubChem CID80795705
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine
SMILESCCC1COC(C)CN1c1ccnc(N)n1
InChIInChI=1S/C11H18N4O/c1-3-9-7-16-8(2)6-15(9)10-4-5-13-11(12)14-10/h4-5,8-9H,3,6-7H2,1-2H3,(H2,12,13,14)
InChIKeyFTSYOUSLGGPFNW-UHFFFAOYSA-N
XLogP1.06
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine?
The IUPAC name of 4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine (CID 80795705) is 4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine?
The canonical SMILES for 4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine is CCC1COC(C)CN1c1ccnc(N)n1.
What is the InChIKey of 4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine?
The InChIKey is FTSYOUSLGGPFNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-3-9-7-16-8(2)6-15(9)10-4-5-13-11(12)14-10/h4-5,8-9H,3,6-7H2,1-2H3,(H2,12,13,14).
What are the key properties of 4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine?
4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine has a molecular weight of 222.29 g/mol, XLogP of 1.06, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-ethyl-2-methylmorpholin-4-yl)pyrimidin-2-amine is sourced from PubChem (CID 80795705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).