N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride

C14H18ClF3N2O2 — CID 119801822

IUPACN-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride
SMILESCl.O=C(NC(Cc1ccccc1)C(F)(F)F)C1COCCN1
InChIInChI=1S/C14H17F3N2O2.ClH/c15-14(16,17)12(8-10-4-2-1-3-5-10)19-13(20)11-9-21-7-6-18-11;/h1-5,11-12,18H,6-9H2,(H,19,20);1H
InChIKeyHFDAKFJXYUTLPZ-UHFFFAOYSA-N
MW338.76 g/mol
LogP1.69
Rot. Bonds4

About N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride

N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride (PubChem CID 119801822) has the molecular formula C14H18ClF3N2O2 and a molecular weight of 338.76 g/mol. Its IUPAC name is N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride
PubChem CID119801822
Molecular FormulaC14H18ClF3N2O2
Molecular Weight338.76 g/mol
Exact Mass338.10
IUPAC NameN-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride
SMILESCl.O=C(NC(Cc1ccccc1)C(F)(F)F)C1COCCN1
InChIInChI=1S/C14H17F3N2O2.ClH/c15-14(16,17)12(8-10-4-2-1-3-5-10)19-13(20)11-9-21-7-6-18-11;/h1-5,11-12,18H,6-9H2,(H,19,20);1H
InChIKeyHFDAKFJXYUTLPZ-UHFFFAOYSA-N
XLogP1.69
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.76
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride 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-[(2R)-1-hydroxy-3-phenylpropan-2-yl]morpholine-3-carboxamide
CID 107861025
(2S)-2-(morpholine-3-carbonylamino)-4-phenylbutanoic acid
CID 104983382
N-[1-(benzylamino)-1-oxopropan-2-yl]morpholine-3-carboxamide;hydrochloride
CID 119750954
(3R)-N-[(2S)-2,3-diphenylpropyl]morpholine-3-carboxamide
CID 124699410
N-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide
CID 107862923
(1R,5S)-N-[(2S)-1,1,1-trifluoro-3-phenylpropan-2-yl]bicyclo[3.1.0]hexane-6-carboxamide
CID 97081865
(3R)-N-[(1S)-1-phenylethyl]morpholine-3-carboxamide
CID 16681349
N-[2-(diethylamino)-3-phenylpropyl]morpholine-3-carboxamide
CID 119849942
N-(2-phenylsulfanylpropyl)morpholine-3-carboxamide;hydrochloride
CID 119804403
N-(2-ethyl-2-phenylbutyl)morpholine-3-carboxamide;hydrochloride
CID 119808337
N-[1-(2-methylphenyl)ethyl]morpholine-3-carboxamide;hydrochloride
CID 119686030
benzyl (3R)-morpholine-3-carboxylate;hydrochloride
CID 46839509

Frequently Asked Questions

What is the IUPAC name of N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride (CID 119801822) is N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride is Cl.O=C(NC(Cc1ccccc1)C(F)(F)F)C1COCCN1.
What is the InChIKey of N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride?
The InChIKey is HFDAKFJXYUTLPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F3N2O2.ClH/c15-14(16,17)12(8-10-4-2-1-3-5-10)19-13(20)11-9-21-7-6-18-11;/h1-5,11-12,18H,6-9H2,(H,19,20);1H.
What are the key properties of N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride?
N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride has a molecular weight of 338.76 g/mol, XLogP of 1.69, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,1,1-trifluoro-3-phenylpropan-2-yl)morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119801822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).