N-(2,4,5-trifluorophenyl)morpholine-2-carboxamide

C11H11F3N2O2 — CID 62816271

IUPACN-(2,4,5-trifluorophenyl)morpholine-2-carboxamide
SMILESO=C(Nc1cc(F)c(F)cc1F)C1CNCCO1
InChIInChI=1S/C11H11F3N2O2/c12-6-3-8(14)9(4-7(6)13)16-11(17)10-5-15-1-2-18-10/h3-4,10,15H,1-2,5H2,(H,16,17)
InChIKeyAXMNCHMNPAIOIO-UHFFFAOYSA-N
MW260.21 g/mol
LogP1.03
Rot. Bonds2

About N-(2,4,5-trifluorophenyl)morpholine-2-carboxamide

N-(2,4,5-trifluorophenyl)morpholine-2-carboxamide (PubChem CID 62816271) has the molecular formula C11H11F3N2O2 and a molecular weight of 260.21 g/mol. Its IUPAC name is N-(2,4,5-trifluorophenyl)morpholine-2-carboxamide.

Molecular Properties

Compound NameN-(2,4,5-trifluorophenyl)morpholine-2-carboxamide
PubChem CID62816271
Molecular FormulaC11H11F3N2O2
Molecular Weight260.21 g/mol
Exact Mass260.08
IUPAC NameN-(2,4,5-trifluorophenyl)morpholine-2-carboxamide
SMILESO=C(Nc1cc(F)c(F)cc1F)C1CNCCO1
InChIInChI=1S/C11H11F3N2O2/c12-6-3-8(14)9(4-7(6)13)16-11(17)10-5-15-1-2-18-10/h3-4,10,15H,1-2,5H2,(H,16,17)
InChIKeyAXMNCHMNPAIOIO-UHFFFAOYSA-N
XLogP1.03
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.21
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Analyze N-(2,4,5-trifluorophenyl)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-fluoro-4-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119675290
N-(2,4,5-trimethoxyphenyl)morpholine-2-carboxamide
CID 119808138
N-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide
CID 81263696
N-(4-chloro-2-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119671690
N-(2-methylsulfanylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119674752
N-(2,4,5-trifluorophenyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119708623
N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride
CID 119723841
N-(6-fluoro-3-pyridinyl)morpholine-2-carboxamide
CID 103808720
N-(4,5-dimethoxy-2-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119679112
N-(5-fluoro-2-pyridinyl)morpholine-2-carboxamide
CID 65480472
N-(2-ethylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119679075
N-(5-bromo-2-morpholin-4-ylphenyl)morpholine-2-carboxamide
CID 119833788

Frequently Asked Questions

What is the IUPAC name of N-(2,4,5-trifluorophenyl)morpholine-2-carboxamide?
The IUPAC name of N-(2,4,5-trifluorophenyl)morpholine-2-carboxamide (CID 62816271) is N-(2,4,5-trifluorophenyl)morpholine-2-carboxamide.
What is the SMILES notation for N-(2,4,5-trifluorophenyl)morpholine-2-carboxamide?
The canonical SMILES for N-(2,4,5-trifluorophenyl)morpholine-2-carboxamide is O=C(Nc1cc(F)c(F)cc1F)C1CNCCO1.
What is the InChIKey of N-(2,4,5-trifluorophenyl)morpholine-2-carboxamide?
The InChIKey is AXMNCHMNPAIOIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3N2O2/c12-6-3-8(14)9(4-7(6)13)16-11(17)10-5-15-1-2-18-10/h3-4,10,15H,1-2,5H2,(H,16,17).
What are the key properties of N-(2,4,5-trifluorophenyl)morpholine-2-carboxamide?
N-(2,4,5-trifluorophenyl)morpholine-2-carboxamide has a molecular weight of 260.21 g/mol, XLogP of 1.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4,5-trifluorophenyl)morpholine-2-carboxamide is sourced from PubChem (CID 62816271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).