N-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide

C9H17F3N2O2 — CID 79261437

IUPACN-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCCCN(CCO)C(=O)CNCC(F)(F)F
InChIInChI=1S/C9H17F3N2O2/c1-2-3-14(4-5-15)8(16)6-13-7-9(10,11)12/h13,15H,2-7H2,1H3
InChIKeyLFXDYDDBKGLTHU-UHFFFAOYSA-N
MW242.24 g/mol
LogP0.37
Rot. Bonds7

About N-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide

N-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 79261437) has the molecular formula C9H17F3N2O2 and a molecular weight of 242.24 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID79261437
Molecular FormulaC9H17F3N2O2
Molecular Weight242.24 g/mol
Exact Mass242.12
IUPAC NameN-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCCCN(CCO)C(=O)CNCC(F)(F)F
InChIInChI=1S/C9H17F3N2O2/c1-2-3-14(4-5-15)8(16)6-13-7-9(10,11)12/h13,15H,2-7H2,1H3
InChIKeyLFXDYDDBKGLTHU-UHFFFAOYSA-N
XLogP0.37
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.24
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-(3-hydroxypropyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 115771238
N-[2-[2-hydroxyethyl(propyl)amino]-2-oxoethyl]propanamide
CID 110907242
N-(2-methoxyethyl)-N-(3-methoxypropyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78957904
N-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 115869500
N-[2-(diethylamino)-2-oxoethyl]-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 78914738
N,N-dipropyl-2-(prop-2-ynylamino)acetamide
CID 112722308
N,N-bis(cyclopropylmethyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78966256
3,3,3-trifluoro-N,N-bis(2-hydroxyethyl)propanamide
CID 61235446
N-(2,2-difluoroethyl)-2-(ethylamino)-N-(2-hydroxyethyl)acetamide
CID 107479472
3-(tert-butylamino)-N-(2-hydroxyethyl)-N-propylpropanamide
CID 60945491
N-methyl-N-[2-oxo-2-(propylamino)ethyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 78914805
N,N-bis(2-hydroxyethyl)butanamide
CID 14455174

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of N-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide (CID 79261437) is N-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide is CCCN(CCO)C(=O)CNCC(F)(F)F.
What is the InChIKey of N-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is LFXDYDDBKGLTHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F3N2O2/c1-2-3-14(4-5-15)8(16)6-13-7-9(10,11)12/h13,15H,2-7H2,1H3.
What are the key properties of N-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide?
N-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 242.24 g/mol, XLogP of 0.37, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-propyl-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 79261437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).