6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine

C15H26N4O — CID 104961764

IUPAC6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine
SMILESCNc1nc(C(C)C)nc(N2C[C@@H](C)O[C@@H](C)C2)c1C
InChIInChI=1S/C15H26N4O/c1-9(2)13-17-14(16-6)12(5)15(18-13)19-7-10(3)20-11(4)8-19/h9-11H,7-8H2,1-6H3,(H,16,17,18)/t10-,11+
InChIKeyIFAPDXWFHVZPEY-PHIMTYICSA-N
MW278.40 g/mol
LogP2.56
Rot. Bonds3

About 6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine

6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine (PubChem CID 104961764) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine
PubChem CID104961764
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine
SMILESCNc1nc(C(C)C)nc(N2C[C@@H](C)O[C@@H](C)C2)c1C
InChIInChI=1S/C15H26N4O/c1-9(2)13-17-14(16-6)12(5)15(18-13)19-7-10(3)20-11(4)8-19/h9-11H,7-8H2,1-6H3,(H,16,17,18)/t10-,11+
InChIKeyIFAPDXWFHVZPEY-PHIMTYICSA-N
XLogP2.56
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine (CID 104961764) is 6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine is CNc1nc(C(C)C)nc(N2C[C@@H](C)O[C@@H](C)C2)c1C.
What is the InChIKey of 6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is IFAPDXWFHVZPEY-PHIMTYICSA-N. The full InChI is InChI=1S/C15H26N4O/c1-9(2)13-17-14(16-6)12(5)15(18-13)19-7-10(3)20-11(4)8-19/h9-11H,7-8H2,1-6H3,(H,16,17,18)/t10-,11+.
What are the key properties of 6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine?
6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 278.40 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 104961764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).