4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine

C13H22N4O2 — CID 50972422

IUPAC4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine
SMILESCC(C)Oc1cc(N2C[C@@H](C)O[C@@H](C)C2)nc(N)n1
InChIInChI=1S/C13H22N4O2/c1-8(2)18-12-5-11(15-13(14)16-12)17-6-9(3)19-10(4)7-17/h5,8-10H,6-7H2,1-4H3,(H2,14,15,16)/t9-,10+
InChIKeyGMUJJTJHAHWTGY-AOOOYVTPSA-N
MW266.34 g/mol
LogP1.46
Rot. Bonds3

About 4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine

4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine (PubChem CID 50972422) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is 4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine.

Molecular Properties

Compound Name4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine
PubChem CID50972422
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC Name4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine
SMILESCC(C)Oc1cc(N2C[C@@H](C)O[C@@H](C)C2)nc(N)n1
InChIInChI=1S/C13H22N4O2/c1-8(2)18-12-5-11(15-13(14)16-12)17-6-9(3)19-10(4)7-17/h5,8-10H,6-7H2,1-4H3,(H2,14,15,16)/t9-,10+
InChIKeyGMUJJTJHAHWTGY-AOOOYVTPSA-N
XLogP1.46
TPSA73.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine?
The IUPAC name of 4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine (CID 50972422) is 4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine.
What is the SMILES notation for 4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine?
The canonical SMILES for 4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine is CC(C)Oc1cc(N2C[C@@H](C)O[C@@H](C)C2)nc(N)n1.
What is the InChIKey of 4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine?
The InChIKey is GMUJJTJHAHWTGY-AOOOYVTPSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-8(2)18-12-5-11(15-13(14)16-12)17-6-9(3)19-10(4)7-17/h5,8-10H,6-7H2,1-4H3,(H2,14,15,16)/t9-,10+.
What are the key properties of 4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine?
4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine has a molecular weight of 266.34 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-propan-2-yloxypyrimidin-2-amine is sourced from PubChem (CID 50972422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).