N-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide

C10H17F3N2O2 — CID 113228352

IUPACN-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide
SMILESCCCN(CC(F)(F)F)C(=O)N1CCOCC1
InChIInChI=1S/C10H17F3N2O2/c1-2-3-15(8-10(11,12)13)9(16)14-4-6-17-7-5-14/h2-8H2,1H3
InChIKeyPOORHPXTBNRWST-UHFFFAOYSA-N
MW254.25 g/mol
LogP1.71
Rot. Bonds3

About N-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide

N-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide (PubChem CID 113228352) has the molecular formula C10H17F3N2O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is N-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide
PubChem CID113228352
Molecular FormulaC10H17F3N2O2
Molecular Weight254.25 g/mol
Exact Mass254.12
IUPAC NameN-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide
SMILESCCCN(CC(F)(F)F)C(=O)N1CCOCC1
InChIInChI=1S/C10H17F3N2O2/c1-2-3-15(8-10(11,12)13)9(16)14-4-6-17-7-5-14/h2-8H2,1H3
InChIKeyPOORHPXTBNRWST-UHFFFAOYSA-N
XLogP1.71
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-bis(2-methoxyethyl)morpholine-4-carboxamide
CID 4254013
N-butyl-N-ethylmorpholine-4-carboxamide
CID 3765981
N,N-diethylmorpholine-4-carboxamide
CID 669641
[2,2-Dimethyl-4-(2,2,2-trifluoroethyl)piperazin-1-yl]-morpholin-4-ylmethanone
CID 75518477
2,2,6,6-tetramethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]morpholine-4-carboxamide
CID 100658017
(2S,6R)-2,6-dimethyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide
CID 103931434
N-(4,4,4-trifluorobutan-2-yl)morpholine-4-carboxamide
CID 104854737
1-[2-(2,2-Difluoroethoxy)ethyl]-1,3-diazinan-2-one
CID 105910406
N-(2,2,3,3-tetrafluoropropyl)morpholine-4-carboxamide
CID 106291106
(3R)-3-methyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide
CID 106774171
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)morpholine-4-carboxamide
CID 107479086
2,6-dimethyl-N-(trifluoromethyl)morpholine-4-carboxamide
CID 108865827

Frequently Asked Questions

What is the IUPAC name of N-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide?
The IUPAC name of N-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide (CID 113228352) is N-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide.
What is the SMILES notation for N-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide?
The canonical SMILES for N-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide is CCCN(CC(F)(F)F)C(=O)N1CCOCC1.
What is the InChIKey of N-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide?
The InChIKey is POORHPXTBNRWST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O2/c1-2-3-15(8-10(11,12)13)9(16)14-4-6-17-7-5-14/h2-8H2,1H3.
What are the key properties of N-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide?
N-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide has a molecular weight of 254.25 g/mol, XLogP of 1.71, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide is sourced from PubChem (CID 113228352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).