N,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine

C11H15F3N4O — CID 56862807

IUPACN,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine
SMILESCN(C)c1cc(N2CCOC(C(F)(F)F)C2)ncn1
InChIInChI=1S/C11H15F3N4O/c1-17(2)9-5-10(16-7-15-9)18-3-4-19-8(6-18)11(12,13)14/h5,7-8H,3-4,6H2,1-2H3
InChIKeyDBGHMACCTSNEMM-UHFFFAOYSA-N
MW276.26 g/mol
LogP1.31
Rot. Bonds2

About N,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine

N,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine (PubChem CID 56862807) has the molecular formula C11H15F3N4O and a molecular weight of 276.26 g/mol. Its IUPAC name is N,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine
PubChem CID56862807
Molecular FormulaC11H15F3N4O
Molecular Weight276.26 g/mol
Exact Mass276.12
IUPAC NameN,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine
SMILESCN(C)c1cc(N2CCOC(C(F)(F)F)C2)ncn1
InChIInChI=1S/C11H15F3N4O/c1-17(2)9-5-10(16-7-15-9)18-3-4-19-8(6-18)11(12,13)14/h5,7-8H,3-4,6H2,1-2H3
InChIKeyDBGHMACCTSNEMM-UHFFFAOYSA-N
XLogP1.31
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.26
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine?
The IUPAC name of N,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine (CID 56862807) is N,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine.
What is the SMILES notation for N,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine?
The canonical SMILES for N,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine is CN(C)c1cc(N2CCOC(C(F)(F)F)C2)ncn1.
What is the InChIKey of N,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine?
The InChIKey is DBGHMACCTSNEMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N4O/c1-17(2)9-5-10(16-7-15-9)18-3-4-19-8(6-18)11(12,13)14/h5,7-8H,3-4,6H2,1-2H3.
What are the key properties of N,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine?
N,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine has a molecular weight of 276.26 g/mol, XLogP of 1.31, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-[2-(trifluoromethyl)morpholin-4-yl]pyrimidin-4-amine is sourced from PubChem (CID 56862807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).