4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine

C10H13F3N4O — CID 95896147

IUPAC4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine
SMILESCc1cc(N2CCO[C@H](C(F)(F)F)C2)nc(N)n1
InChIInChI=1S/C10H13F3N4O/c1-6-4-8(16-9(14)15-6)17-2-3-18-7(5-17)10(11,12)13/h4,7H,2-3,5H2,1H3,(H2,14,15,16)/t7-/m0/s1
InChIKeyPYWVZTKPCXUONH-ZETCQYMHSA-N
MW262.23 g/mol
LogP1.13
Rot. Bonds1

About 4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine

4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine (PubChem CID 95896147) has the molecular formula C10H13F3N4O and a molecular weight of 262.23 g/mol. Its IUPAC name is 4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine
PubChem CID95896147
Molecular FormulaC10H13F3N4O
Molecular Weight262.23 g/mol
Exact Mass262.10
IUPAC Name4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine
SMILESCc1cc(N2CCO[C@H](C(F)(F)F)C2)nc(N)n1
InChIInChI=1S/C10H13F3N4O/c1-6-4-8(16-9(14)15-6)17-2-3-18-7(5-17)10(11,12)13/h4,7H,2-3,5H2,1H3,(H2,14,15,16)/t7-/m0/s1
InChIKeyPYWVZTKPCXUONH-ZETCQYMHSA-N
XLogP1.13
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.23
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-Isopropyl-6-methyl-4-pyrimidinyl)morpholine
CID 3306908
4,4'-(6-Methylpyrimidine-2,4-diyl)dimorpholine
CID 239982
4-(4,6-Dimethylpyrimidin-2-yl)morpholine
CID 676802
4-(4-Methyl-6-piperidin-1-ylpyrimidin-2-yl)morpholine
CID 697254
4,6-dimethyl-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine
CID 1646798
N,6-dimethyl-2-morpholin-4-ylpyrimidin-4-amine
CID 697248
4-(2-Isopropyl-6-methyl-4-pyrimidinyl)-2,6-dimethylmorpholine
CID 4317583
4-[4-Methyl-6-(4-methyl-1-piperazinyl)-2-pyrimidinyl]morpholine
CID 647957
N-butyl-6-methyl-2-(4-morpholinyl)-4-pyrimidinamine
CID 1880359
2-Amino-4-morpholino-6-methylpyrimidine
CID 3642905
2-(6-Methyl-2-morpholin-4-yl-pyrimidin-4-ylamino)-ethanol
CID 1918227
6-Methyl-2-(morpholin-4-yl)pyrimidin-4-amine
CID 13537844

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine?
The IUPAC name of 4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine (CID 95896147) is 4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine.
What is the SMILES notation for 4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine?
The canonical SMILES for 4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine is Cc1cc(N2CCO[C@H](C(F)(F)F)C2)nc(N)n1.
What is the InChIKey of 4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine?
The InChIKey is PYWVZTKPCXUONH-ZETCQYMHSA-N. The full InChI is InChI=1S/C10H13F3N4O/c1-6-4-8(16-9(14)15-6)17-2-3-18-7(5-17)10(11,12)13/h4,7H,2-3,5H2,1H3,(H2,14,15,16)/t7-/m0/s1.
What are the key properties of 4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine?
4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine has a molecular weight of 262.23 g/mol, XLogP of 1.13, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrimidin-2-amine is sourced from PubChem (CID 95896147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).