N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide

C20H16ClF3N4O2 — CID 55675925

IUPACN-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
SMILESO=C(Cn1c(C(F)(F)F)nc2ccccc21)Nc1cc(N2CCCC2=O)ccc1Cl
InChIInChI=1S/C20H16ClF3N4O2/c21-13-8-7-12(27-9-3-6-18(27)30)10-15(13)25-17(29)11-28-16-5-2-1-4-14(16)26-19(28)20(22,23)24/h1-2,4-5,7-8,10H,3,6,9,11H2,(H,25,29)
InChIKeyLQRXEWPTVGMJNY-UHFFFAOYSA-N
MW436.82 g/mol
LogP4.47
Rot. Bonds4

About N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide

N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide (PubChem CID 55675925) has the molecular formula C20H16ClF3N4O2 and a molecular weight of 436.82 g/mol. Its IUPAC name is N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
PubChem CID55675925
Molecular FormulaC20H16ClF3N4O2
Molecular Weight436.82 g/mol
Exact Mass436.09
IUPAC NameN-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
SMILESO=C(Cn1c(C(F)(F)F)nc2ccccc21)Nc1cc(N2CCCC2=O)ccc1Cl
InChIInChI=1S/C20H16ClF3N4O2/c21-13-8-7-12(27-9-3-6-18(27)30)10-15(13)25-17(29)11-28-16-5-2-1-4-14(16)26-19(28)20(22,23)24/h1-2,4-5,7-8,10H,3,6,9,11H2,(H,25,29)
InChIKeyLQRXEWPTVGMJNY-UHFFFAOYSA-N
XLogP4.47
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.82
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
CID 55874064
N-(2-piperidin-1-ylsulfonylphenyl)-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
CID 60549313
N-[2-(piperidine-1-carbonyl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
CID 35275235
N-(2-morpholin-4-ylphenyl)-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
CID 4878936
N-(4-oxo-1H-pyridin-3-yl)-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
CID 51114324
N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-(4-pyrrol-1-ylphenyl)acetamide
CID 55675256
N-(2-fluoro-5-methylphenyl)-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
CID 40723406
N-(9,10-dioxoanthracen-1-yl)-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
CID 39045058
N-(1-methylcyclobutyl)-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
CID 46970987
N-[2-(difluoromethylsulfanyl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
CID 40723417
N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide
CID 26880814
1-pyrrolidin-1-yl-2-[2-(trifluoromethyl)benzimidazol-1-yl]ethanone
CID 1477753

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide?
The IUPAC name of N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide (CID 55675925) is N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide.
What is the SMILES notation for N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide?
The canonical SMILES for N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide is O=C(Cn1c(C(F)(F)F)nc2ccccc21)Nc1cc(N2CCCC2=O)ccc1Cl.
What is the InChIKey of N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide?
The InChIKey is LQRXEWPTVGMJNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClF3N4O2/c21-13-8-7-12(27-9-3-6-18(27)30)10-15(13)25-17(29)11-28-16-5-2-1-4-14(16)26-19(28)20(22,23)24/h1-2,4-5,7-8,10H,3,6,9,11H2,(H,25,29).
What are the key properties of N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide?
N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide has a molecular weight of 436.82 g/mol, XLogP of 4.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-5-(2-oxopyrrolidin-1-yl)phenyl]-2-[2-(trifluoromethyl)benzimidazol-1-yl]acetamide is sourced from PubChem (CID 55675925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).