N-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide

C10H15F3N2O2 — CID 119748920

IUPACN-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide
SMILESC=CCN(CC(F)(F)F)C(=O)C1CNCCO1
InChIInChI=1S/C10H15F3N2O2/c1-2-4-15(7-10(11,12)13)9(16)8-6-14-3-5-17-8/h2,8,14H,1,3-7H2
InChIKeyYRQQTJBAKJXLST-UHFFFAOYSA-N
MW252.24 g/mol
LogP0.55
Rot. Bonds4

About N-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide

N-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide (PubChem CID 119748920) has the molecular formula C10H15F3N2O2 and a molecular weight of 252.24 g/mol. Its IUPAC name is N-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide.

Molecular Properties

Compound NameN-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide
PubChem CID119748920
Molecular FormulaC10H15F3N2O2
Molecular Weight252.24 g/mol
Exact Mass252.11
IUPAC NameN-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide
SMILESC=CCN(CC(F)(F)F)C(=O)C1CNCCO1
InChIInChI=1S/C10H15F3N2O2/c1-2-4-15(7-10(11,12)13)9(16)8-6-14-3-5-17-8/h2,8,14H,1,3-7H2
InChIKeyYRQQTJBAKJXLST-UHFFFAOYSA-N
XLogP0.55
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.24
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-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-(2,2,2-trifluoroethyl)morpholine-2-carboxamide
CID 61736280
N-methyl-4-(2,2,2-trifluoroethyl)morpholine-2-carboxamide
CID 75501672
N,N-bis(2,2,2-trifluoroethyl)morpholine-2-carboxamide
CID 86245682
(2,2-Difluoroazetidin-1-yl)-morpholin-2-ylmethanone
CID 173899256
N-methyl-5-oxo-4-(2,2,2-trifluoroethyl)morpholine-2-carboxamide
CID 176360401
N-methyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide
CID 61736524
N-butyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide
CID 61738698
N-propyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide
CID 61738699
N-ethyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide
CID 61739131
N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide
CID 61739484
N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide
CID 61741232
N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide
CID 63227052

Frequently Asked Questions

What is the IUPAC name of N-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide?
The IUPAC name of N-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide (CID 119748920) is N-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide.
What is the SMILES notation for N-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide?
The canonical SMILES for N-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide is C=CCN(CC(F)(F)F)C(=O)C1CNCCO1.
What is the InChIKey of N-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide?
The InChIKey is YRQQTJBAKJXLST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F3N2O2/c1-2-4-15(7-10(11,12)13)9(16)8-6-14-3-5-17-8/h2,8,14H,1,3-7H2.
What are the key properties of N-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide?
N-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide has a molecular weight of 252.24 g/mol, XLogP of 0.55, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enyl-N-(2,2,2-trifluoroethyl)morpholine-2-carboxamide is sourced from PubChem (CID 119748920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).