[5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol

C10H12F3N3O2 — CID 164642334

IUPAC[5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol
SMILESOCc1cnc(N2CCO[C@H](C(F)(F)F)C2)cn1
InChIInChI=1S/C10H12F3N3O2/c11-10(12,13)8-5-16(1-2-18-8)9-4-14-7(6-17)3-15-9/h3-4,8,17H,1-2,5-6H2/t8-/m0/s1
InChIKeyVPWQKNWZRABANX-QMMMGPOBSA-N
MW263.22 g/mol
LogP0.74
Rot. Bonds2

About [5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol

[5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol (PubChem CID 164642334) has the molecular formula C10H12F3N3O2 and a molecular weight of 263.22 g/mol. Its IUPAC name is [5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol.

Molecular Properties

Compound Name[5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol
PubChem CID164642334
Molecular FormulaC10H12F3N3O2
Molecular Weight263.22 g/mol
Exact Mass263.09
IUPAC Name[5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol
SMILESOCc1cnc(N2CCO[C@H](C(F)(F)F)C2)cn1
InChIInChI=1S/C10H12F3N3O2/c11-10(12,13)8-5-16(1-2-18-8)9-4-14-7(6-17)3-15-9/h3-4,8,17H,1-2,5-6H2/t8-/m0/s1
InChIKeyVPWQKNWZRABANX-QMMMGPOBSA-N
XLogP0.74
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.22
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol?
The IUPAC name of [5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol (CID 164642334) is [5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol.
What is the SMILES notation for [5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol?
The canonical SMILES for [5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol is OCc1cnc(N2CCO[C@H](C(F)(F)F)C2)cn1.
What is the InChIKey of [5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol?
The InChIKey is VPWQKNWZRABANX-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H12F3N3O2/c11-10(12,13)8-5-16(1-2-18-8)9-4-14-7(6-17)3-15-9/h3-4,8,17H,1-2,5-6H2/t8-/m0/s1.
What are the key properties of [5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol?
[5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol has a molecular weight of 263.22 g/mol, XLogP of 0.74, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(2S)-2-(trifluoromethyl)morpholin-4-yl]pyrazin-2-yl]methanol is sourced from PubChem (CID 164642334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).