N-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide

C19H25F3N2O2 — CID 78896719

IUPACN-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
SMILESCC1CN(CC(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)C(C)CO1
InChIInChI=1S/C19H25F3N2O2/c1-13-12-26-14(2)9-23(13)11-18(25)24(17-7-8-17)10-15-3-5-16(6-4-15)19(20,21)22/h3-6,13-14,17H,7-12H2,1-2H3
InChIKeyCCKUWBJLBOQMMG-UHFFFAOYSA-N
MW370.42 g/mol
LogP3.31
Rot. Bonds5

About N-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide

N-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide (PubChem CID 78896719) has the molecular formula C19H25F3N2O2 and a molecular weight of 370.42 g/mol. Its IUPAC name is N-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
PubChem CID78896719
Molecular FormulaC19H25F3N2O2
Molecular Weight370.42 g/mol
Exact Mass370.19
IUPAC NameN-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
SMILESCC1CN(CC(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)C(C)CO1
InChIInChI=1S/C19H25F3N2O2/c1-13-12-26-14(2)9-23(13)11-18(25)24(17-7-8-17)10-15-3-5-16(6-4-15)19(20,21)22/h3-6,13-14,17H,7-12H2,1-2H3
InChIKeyCCKUWBJLBOQMMG-UHFFFAOYSA-N
XLogP3.31
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.42
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide?
The IUPAC name of N-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide (CID 78896719) is N-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide?
The canonical SMILES for N-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide is CC1CN(CC(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)C(C)CO1.
What is the InChIKey of N-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide?
The InChIKey is CCKUWBJLBOQMMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25F3N2O2/c1-13-12-26-14(2)9-23(13)11-18(25)24(17-7-8-17)10-15-3-5-16(6-4-15)19(20,21)22/h3-6,13-14,17H,7-12H2,1-2H3.
What are the key properties of N-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide?
N-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide has a molecular weight of 370.42 g/mol, XLogP of 3.31, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(2,5-dimethylmorpholin-4-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide is sourced from PubChem (CID 78896719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).