(2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide

C10H16F4N2O3 — CID 7375449

IUPAC(2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide
SMILESCO[C@](F)(C(=O)NCCN1CCOCC1)C(F)(F)F
InChIInChI=1S/C10H16F4N2O3/c1-18-9(11,10(12,13)14)8(17)15-2-3-16-4-6-19-7-5-16/h2-7H2,1H3,(H,15,17)/t9-/m1/s1
InChIKeyVNRXVOJOSQNMIG-SECBINFHSA-N
MW288.24 g/mol
LogP0.31
Rot. Bonds5

About (2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide

(2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide (PubChem CID 7375449) has the molecular formula C10H16F4N2O3 and a molecular weight of 288.24 g/mol. Its IUPAC name is (2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide.

Molecular Properties

Compound Name(2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide
PubChem CID7375449
Molecular FormulaC10H16F4N2O3
Molecular Weight288.24 g/mol
Exact Mass288.11
IUPAC Name(2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide
SMILESCO[C@](F)(C(=O)NCCN1CCOCC1)C(F)(F)F
InChIInChI=1S/C10H16F4N2O3/c1-18-9(11,10(12,13)14)8(17)15-2-3-16-4-6-19-7-5-16/h2-7H2,1H3,(H,15,17)/t9-/m1/s1
InChIKeyVNRXVOJOSQNMIG-SECBINFHSA-N
XLogP0.31
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.24
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide?
The IUPAC name of (2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide (CID 7375449) is (2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide.
What is the SMILES notation for (2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide?
The canonical SMILES for (2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide is CO[C@](F)(C(=O)NCCN1CCOCC1)C(F)(F)F.
What is the InChIKey of (2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide?
The InChIKey is VNRXVOJOSQNMIG-SECBINFHSA-N. The full InChI is InChI=1S/C10H16F4N2O3/c1-18-9(11,10(12,13)14)8(17)15-2-3-16-4-6-19-7-5-16/h2-7H2,1H3,(H,15,17)/t9-/m1/s1.
What are the key properties of (2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide?
(2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide has a molecular weight of 288.24 g/mol, XLogP of 0.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2,3,3,3-tetrafluoro-2-methoxy-N-(2-morpholin-4-ylethyl)propanamide is sourced from PubChem (CID 7375449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).