2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide

C14H21F3N4O2 — CID 146085061

IUPAC2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide
SMILESCC1CN(C(=O)NCc2nccn2CC(F)(F)F)CC(C)(C)O1
InChIInChI=1S/C14H21F3N4O2/c1-10-7-21(8-13(2,3)23-10)12(22)19-6-11-18-4-5-20(11)9-14(15,16)17/h4-5,10H,6-9H2,1-3H3,(H,19,22)
InChIKeySNJPGNSTMLANRJ-UHFFFAOYSA-N
MW334.34 g/mol
LogP2.15
Rot. Bonds3

About 2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide

2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide (PubChem CID 146085061) has the molecular formula C14H21F3N4O2 and a molecular weight of 334.34 g/mol. Its IUPAC name is 2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide
PubChem CID146085061
Molecular FormulaC14H21F3N4O2
Molecular Weight334.34 g/mol
Exact Mass334.16
IUPAC Name2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide
SMILESCC1CN(C(=O)NCc2nccn2CC(F)(F)F)CC(C)(C)O1
InChIInChI=1S/C14H21F3N4O2/c1-10-7-21(8-13(2,3)23-10)12(22)19-6-11-18-4-5-20(11)9-14(15,16)17/h4-5,10H,6-9H2,1-3H3,(H,19,22)
InChIKeySNJPGNSTMLANRJ-UHFFFAOYSA-N
XLogP2.15
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.34
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide with MolForge

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Related Compounds

N-[(2-methoxy-3-pyridinyl)methyl]-2,2,6-trimethylmorpholine-4-carboxamide
CID 48712863
4-acetyl-N'-methyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]piperazine-1-carboximidamide;hydroiodide
CID 119115978
2-(2,2,2-trifluoroethylamino)-1-(2,2,6-trimethylmorpholin-4-yl)ethanone
CID 78958244
2,2,6-trimethyl-N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]morpholine-4-carboxamide
CID 48713515
methyl (2R,6R)-6-methyl-4-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-2-carboxylate
CID 97064946
2,2,6-trimethyl-N-[2-(2,2,2-trifluoroethyl)-1,3-dihydroisoindol-4-yl]morpholine-4-carboxamide
CID 102562753
2,2,6-trimethyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]morpholine-4-carboxamide
CID 48712827
(6S)-2,2,6-trimethyl-N-[2-(2,2,2-trifluoroethyl)-1,3-dihydroisoindol-4-yl]morpholine-4-carboxamide
CID 99793940
N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrrolidine-2-carboxamide
CID 119876342
2-phenyl-1-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methylcarbamoyl]cyclopropane-1-carboxylic acid
CID 167866056
1-cyclopentyl-2-methyl-3-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]guanidine;hydroiodide
CID 119116693
N'-methyl-3-piperidin-1-yl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]pyrrolidine-1-carboximidamide
CID 119142967

Frequently Asked Questions

What is the IUPAC name of 2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide?
The IUPAC name of 2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide (CID 146085061) is 2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide.
What is the SMILES notation for 2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide?
The canonical SMILES for 2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide is CC1CN(C(=O)NCc2nccn2CC(F)(F)F)CC(C)(C)O1.
What is the InChIKey of 2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide?
The InChIKey is SNJPGNSTMLANRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21F3N4O2/c1-10-7-21(8-13(2,3)23-10)12(22)19-6-11-18-4-5-20(11)9-14(15,16)17/h4-5,10H,6-9H2,1-3H3,(H,19,22).
What are the key properties of 2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide?
2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide has a molecular weight of 334.34 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6-trimethyl-N-[[1-(2,2,2-trifluoroethyl)imidazol-2-yl]methyl]morpholine-4-carboxamide is sourced from PubChem (CID 146085061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).