N-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide

C17H21F3N2O2 — CID 94799529

IUPACN-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide
SMILESO=C(NC[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)C1CC1
InChIInChI=1S/C17H21F3N2O2/c18-17(19,20)14-5-3-12(4-6-14)15(22-7-9-24-10-8-22)11-21-16(23)13-1-2-13/h3-6,13,15H,1-2,7-11H2,(H,21,23)/t15-/m0/s1
InChIKeyHPZGHMRMXASKNC-HNNXBMFYSA-N
MW342.36 g/mol
LogP2.60
Rot. Bonds5

About N-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide

N-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide (PubChem CID 94799529) has the molecular formula C17H21F3N2O2 and a molecular weight of 342.36 g/mol. Its IUPAC name is N-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide
PubChem CID94799529
Molecular FormulaC17H21F3N2O2
Molecular Weight342.36 g/mol
Exact Mass342.16
IUPAC NameN-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide
SMILESO=C(NC[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)C1CC1
InChIInChI=1S/C17H21F3N2O2/c18-17(19,20)14-5-3-12(4-6-14)15(22-7-9-24-10-8-22)11-21-16(23)13-1-2-13/h3-6,13,15H,1-2,7-11H2,(H,21,23)/t15-/m0/s1
InChIKeyHPZGHMRMXASKNC-HNNXBMFYSA-N
XLogP2.60
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.36
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]piperidine-3-carboxamide
CID 119872524
N-(2-morpholin-4-yl-2-phenylethyl)cyclobutanecarboxamide
CID 42948395
N-(2-morpholin-4-yl-2-phenylethyl)cyclopentanecarboxamide
CID 42948396
2-methyl-3-(methylamino)-N-[2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]propanamide
CID 119872548
N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-(trifluoromethyl)benzamide
CID 51641243
N-[(2S)-2-(4-methylphenyl)-2-morpholin-4-ylethyl]cyclohexanecarboxamide
CID 51630213
(2R)-2-methylsulfanyl-N-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]propanamide
CID 52511635
(2R)-2-methylsulfanyl-N-[(2S)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]propanamide
CID 52511637
1,2-dimethyl-3-[2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]guanidine
CID 91641994
N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)cyclopropanecarboxamide
CID 16931690
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]cyclohexanecarboxamide
CID 16811484
4-(methylamino)-N-[2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]butanamide;dihydrochloride
CID 119872533

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide?
The IUPAC name of N-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide (CID 94799529) is N-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide is O=C(NC[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)C1CC1.
What is the InChIKey of N-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide?
The InChIKey is HPZGHMRMXASKNC-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H21F3N2O2/c18-17(19,20)14-5-3-12(4-6-14)15(22-7-9-24-10-8-22)11-21-16(23)13-1-2-13/h3-6,13,15H,1-2,7-11H2,(H,21,23)/t15-/m0/s1.
What are the key properties of N-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide?
N-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide has a molecular weight of 342.36 g/mol, XLogP of 2.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]cyclopropanecarboxamide is sourced from PubChem (CID 94799529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).