2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide

C8H14F4N2O — CID 106291856

IUPAC2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide
SMILESCCCNCC(=O)NCC(F)(F)C(F)F
InChIInChI=1S/C8H14F4N2O/c1-2-3-13-4-6(15)14-5-8(11,12)7(9)10/h7,13H,2-5H2,1H3,(H,14,15)
InChIKeyURPFFKXQEQCIGI-UHFFFAOYSA-N
MW230.20 g/mol
LogP1.00
Rot. Bonds7

About 2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide

2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide (PubChem CID 106291856) has the molecular formula C8H14F4N2O and a molecular weight of 230.20 g/mol. Its IUPAC name is 2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide.

Molecular Properties

Compound Name2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide
PubChem CID106291856
Molecular FormulaC8H14F4N2O
Molecular Weight230.20 g/mol
Exact Mass230.10
IUPAC Name2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide
SMILESCCCNCC(=O)NCC(F)(F)C(F)F
InChIInChI=1S/C8H14F4N2O/c1-2-3-13-4-6(15)14-5-8(11,12)7(9)10/h7,13H,2-5H2,1H3,(H,14,15)
InChIKeyURPFFKXQEQCIGI-UHFFFAOYSA-N
XLogP1.00
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.20
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(ethylamino)-N-(2,2,3,3-tetrafluoropropyl)propanamide
CID 106291636
N-(2-methoxy-2-methylpropyl)-2-(propylamino)acetamide
CID 104761261
2-ethoxy-N-(2,2,3,3-tetrafluoropropyl)acetamide
CID 103528809
2-sulfanyl-N-(2,2,3,3-tetrafluoropropyl)acetamide
CID 106295758
4-hydroxy-N-(2,2,3,3-tetrafluoropropyl)pentanamide
CID 106295708
2-propan-2-yloxy-N-(2,2,3,3-tetrafluoropropyl)acetamide
CID 103528341
2-(propylamino)-N-(2,3,3-trimethylbutyl)acetamide
CID 83143043
methyl N-(2,2,3,3-tetrafluoropropyl)carbamate
CID 103528765
2-(2-ethylsulfonylethylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 114110989
1-ethyl-1-methyl-3-(2,2,3,3-tetrafluoropropyl)urea
CID 106291111
N-methyl-2-(propylamino)acetamide
CID 28586328
N-propan-2-yl-2-(propylamino)acetamide
CID 28586282

Frequently Asked Questions

What is the IUPAC name of 2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide?
The IUPAC name of 2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide (CID 106291856) is 2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide.
What is the SMILES notation for 2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide?
The canonical SMILES for 2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide is CCCNCC(=O)NCC(F)(F)C(F)F.
What is the InChIKey of 2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide?
The InChIKey is URPFFKXQEQCIGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F4N2O/c1-2-3-13-4-6(15)14-5-8(11,12)7(9)10/h7,13H,2-5H2,1H3,(H,14,15).
What are the key properties of 2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide?
2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide has a molecular weight of 230.20 g/mol, XLogP of 1.00, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(propylamino)-N-(2,2,3,3-tetrafluoropropyl)acetamide is sourced from PubChem (CID 106291856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).