3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide

C15H25F3N2O3 — CID 84600115

IUPAC3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide
SMILESCC(O)CC1COCCN1C(=O)NC1CCC(C(F)(F)F)CC1
InChIInChI=1S/C15H25F3N2O3/c1-10(21)8-13-9-23-7-6-20(13)14(22)19-12-4-2-11(3-5-12)15(16,17)18/h10-13,21H,2-9H2,1H3,(H,19,22)
InChIKeyWAHMZKDKUXCPMP-UHFFFAOYSA-N
MW338.37 g/mol
LogP2.29
Rot. Bonds3

About 3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide

3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide (PubChem CID 84600115) has the molecular formula C15H25F3N2O3 and a molecular weight of 338.37 g/mol. Its IUPAC name is 3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide
PubChem CID84600115
Molecular FormulaC15H25F3N2O3
Molecular Weight338.37 g/mol
Exact Mass338.18
IUPAC Name3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide
SMILESCC(O)CC1COCCN1C(=O)NC1CCC(C(F)(F)F)CC1
InChIInChI=1S/C15H25F3N2O3/c1-10(21)8-13-9-23-7-6-20(13)14(22)19-12-4-2-11(3-5-12)15(16,17)18/h10-13,21H,2-9H2,1H3,(H,19,22)
InChIKeyWAHMZKDKUXCPMP-UHFFFAOYSA-N
XLogP2.29
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyclopentylethyl)-3-(2-hydroxypropyl)morpholine-4-carboxamide
CID 75509294
3-(2-hydroxypropyl)-N-(4-methylhexan-2-yl)morpholine-4-carboxamide
CID 86795742
N-(1,1-difluorobutan-2-yl)-2-methyl-1-oxa-4-azaspiro[5.5]undecane-4-carboxamide
CID 132388008
N-[(4,4-difluorocyclohexyl)methyl]-2-(methoxymethyl)-6-methylmorpholine-4-carboxamide
CID 136540520
[1-(Ethylcarbamoyl)-2-[[4-(trifluoromethyl)cyclohexyl]oxymethyl]piperidin-3-yl]azanium
CID 163481423
(2R,3S)-3-amino-N-ethyl-2-[[4-(trifluoromethyl)cyclohexyl]oxymethyl]piperidine-1-carboxamide
CID 166854308
3-cyclopropyl-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide
CID 75434369
N-(2-methoxycyclohexyl)-4-(2,2,2-trifluoro-1-hydroxyethyl)piperidine-1-carboxamide
CID 75469008
4-hydroxy-N-(2-methoxycyclohexyl)-4-(trifluoromethyl)piperidine-1-carboxamide
CID 75471767
4-hydroxy-N-(2-methyloxolan-3-yl)-4-(trifluoromethyl)piperidine-1-carboxamide
CID 75483152
1-Methyl-3-(1-oxaspiro[5.5]undecan-4-yl)-1-(3,3,3-trifluoro-2-hydroxypropyl)urea
CID 75505748
3-(2-hydroxypropyl)-N-(3,3,3-trifluoropropyl)morpholine-4-carboxamide
CID 91660791

Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide?
The IUPAC name of 3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide (CID 84600115) is 3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide.
What is the SMILES notation for 3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide?
The canonical SMILES for 3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide is CC(O)CC1COCCN1C(=O)NC1CCC(C(F)(F)F)CC1.
What is the InChIKey of 3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide?
The InChIKey is WAHMZKDKUXCPMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25F3N2O3/c1-10(21)8-13-9-23-7-6-20(13)14(22)19-12-4-2-11(3-5-12)15(16,17)18/h10-13,21H,2-9H2,1H3,(H,19,22).
What are the key properties of 3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide?
3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide has a molecular weight of 338.37 g/mol, XLogP of 2.29, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxypropyl)-N-[4-(trifluoromethyl)cyclohexyl]morpholine-4-carboxamide is sourced from PubChem (CID 84600115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).