N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide

C18H17F3N4O3 — CID 53187426

IUPACN-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide
SMILESCCN1CCN(c2ccc(NC(=O)c3ccc(OC(F)(F)F)cc3)cn2)C1=O
InChIInChI=1S/C18H17F3N4O3/c1-2-24-9-10-25(17(24)27)15-8-5-13(11-22-15)23-16(26)12-3-6-14(7-4-12)28-18(19,20)21/h3-8,11H,2,9-10H2,1H3,(H,23,26)
InChIKeyZOMJNVVOYHDFBL-UHFFFAOYSA-N
MW394.35 g/mol
LogP3.49
Rot. Bonds5

About N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide

N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide (PubChem CID 53187426) has the molecular formula C18H17F3N4O3 and a molecular weight of 394.35 g/mol. Its IUPAC name is N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide.

Molecular Properties

Compound NameN-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide
PubChem CID53187426
Molecular FormulaC18H17F3N4O3
Molecular Weight394.35 g/mol
Exact Mass394.13
IUPAC NameN-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide
SMILESCCN1CCN(c2ccc(NC(=O)c3ccc(OC(F)(F)F)cc3)cn2)C1=O
InChIInChI=1S/C18H17F3N4O3/c1-2-24-9-10-25(17(24)27)15-8-5-13(11-22-15)23-16(26)12-3-6-14(7-4-12)28-18(19,20)21/h3-8,11H,2,9-10H2,1H3,(H,23,26)
InChIKeyZOMJNVVOYHDFBL-UHFFFAOYSA-N
XLogP3.49
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.35
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-3-(trifluoromethoxy)benzamide
CID 53187440
N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-methylbenzamide
CID 53187463
N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2,4-dimethoxybenzamide
CID 53187395
N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-3-methylthiophene-2-carboxamide
CID 53187421
4-chloro-N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-2-methoxybenzamide
CID 53187433
N-[6-(dimethylamino)-3-pyridinyl]-4-(trifluoromethoxy)benzamide
CID 37350824
N-(2-piperidin-1-ylpyrimidin-5-yl)-4-(trifluoromethoxy)benzamide
CID 122298622
4-ethoxy-N-(6-pyrrolidin-1-yl-3-pyridinyl)benzamide
CID 41303356
N-[6-(2-oxo-3-phenylimidazolidin-1-yl)-3-pyridinyl]benzamide
CID 53187688
N-[2-(dimethylamino)pyrimidin-5-yl]-4-(trifluoromethoxy)benzamide
CID 122297980
N-[2-(4-methylpiperidin-1-yl)pyrimidin-5-yl]-4-(trifluoromethoxy)benzamide
CID 122299773
6-morpholin-4-ylpyridine-3-carboxylic acid;6-morpholin-4-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;4-(trifluoromethoxy)aniline
CID 158050226

Frequently Asked Questions

What is the IUPAC name of N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide?
The IUPAC name of N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide (CID 53187426) is N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide.
What is the SMILES notation for N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide?
The canonical SMILES for N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide is CCN1CCN(c2ccc(NC(=O)c3ccc(OC(F)(F)F)cc3)cn2)C1=O.
What is the InChIKey of N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide?
The InChIKey is ZOMJNVVOYHDFBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F3N4O3/c1-2-24-9-10-25(17(24)27)15-8-5-13(11-22-15)23-16(26)12-3-6-14(7-4-12)28-18(19,20)21/h3-8,11H,2,9-10H2,1H3,(H,23,26).
What are the key properties of N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide?
N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide has a molecular weight of 394.35 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3-ethyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]-4-(trifluoromethoxy)benzamide is sourced from PubChem (CID 53187426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).