1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol

C10H17F4NO3 — CID 58855446

IUPAC1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol
SMILESOC(COCC(F)(F)C(F)F)CN1CCOCC1
InChIInChI=1S/C10H17F4NO3/c11-9(12)10(13,14)7-18-6-8(16)5-15-1-3-17-4-2-15/h8-9,16H,1-7H2
InChIKeyMXFATWKIEVSDKQ-UHFFFAOYSA-N
MW275.24 g/mol
LogP0.60
Rot. Bonds7

About 1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol

1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol (PubChem CID 58855446) has the molecular formula C10H17F4NO3 and a molecular weight of 275.24 g/mol. Its IUPAC name is 1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol.

Molecular Properties

Compound Name1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol
PubChem CID58855446
Molecular FormulaC10H17F4NO3
Molecular Weight275.24 g/mol
Exact Mass275.11
IUPAC Name1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol
SMILESOC(COCC(F)(F)C(F)F)CN1CCOCC1
InChIInChI=1S/C10H17F4NO3/c11-9(12)10(13,14)7-18-6-8(16)5-15-1-3-17-4-2-15/h8-9,16H,1-7H2
InChIKeyMXFATWKIEVSDKQ-UHFFFAOYSA-N
XLogP0.60
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.24
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol?
The IUPAC name of 1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol (CID 58855446) is 1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol.
What is the SMILES notation for 1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol?
The canonical SMILES for 1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol is OC(COCC(F)(F)C(F)F)CN1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol?
The InChIKey is MXFATWKIEVSDKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F4NO3/c11-9(12)10(13,14)7-18-6-8(16)5-15-1-3-17-4-2-15/h8-9,16H,1-7H2.
What are the key properties of 1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol?
1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol has a molecular weight of 275.24 g/mol, XLogP of 0.60, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-3-(2,2,3,3-tetrafluoropropoxy)propan-2-ol is sourced from PubChem (CID 58855446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).