2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide

C6H11F3N2O2 — CID 103809664

IUPAC2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide
SMILESCNCC(=O)NCC(O)C(F)(F)F
InChIInChI=1S/C6H11F3N2O2/c1-10-3-5(13)11-2-4(12)6(7,8)9/h4,10,12H,2-3H2,1H3,(H,11,13)
InChIKeyHDVSUAQSYQOTHQ-UHFFFAOYSA-N
MW200.16 g/mol
LogP-0.75
Rot. Bonds4

About 2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide

2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide (PubChem CID 103809664) has the molecular formula C6H11F3N2O2 and a molecular weight of 200.16 g/mol. Its IUPAC name is 2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide.

Molecular Properties

Compound Name2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide
PubChem CID103809664
Molecular FormulaC6H11F3N2O2
Molecular Weight200.16 g/mol
Exact Mass200.08
IUPAC Name2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide
SMILESCNCC(=O)NCC(O)C(F)(F)F
InChIInChI=1S/C6H11F3N2O2/c1-10-3-5(13)11-2-4(12)6(7,8)9/h4,10,12H,2-3H2,1H3,(H,11,13)
InChIKeyHDVSUAQSYQOTHQ-UHFFFAOYSA-N
XLogP-0.75
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.16
LogP ≤ 5-0.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide?
The IUPAC name of 2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide (CID 103809664) is 2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide.
What is the SMILES notation for 2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide?
The canonical SMILES for 2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide is CNCC(=O)NCC(O)C(F)(F)F.
What is the InChIKey of 2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide?
The InChIKey is HDVSUAQSYQOTHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F3N2O2/c1-10-3-5(13)11-2-4(12)6(7,8)9/h4,10,12H,2-3H2,1H3,(H,11,13).
What are the key properties of 2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide?
2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide has a molecular weight of 200.16 g/mol, XLogP of -0.75, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(3,3,3-trifluoro-2-hydroxypropyl)acetamide is sourced from PubChem (CID 103809664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).