2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide

C19H20ClN3O2 — CID 54810281

IUPAC2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide
SMILESO=C(CNc1ccc(Cl)cc1)Nc1ccc(C(=O)N2CCCC2)cc1
InChIInChI=1S/C19H20ClN3O2/c20-15-5-9-16(10-6-15)21-13-18(24)22-17-7-3-14(4-8-17)19(25)23-11-1-2-12-23/h3-10,21H,1-2,11-13H2,(H,22,24)
InChIKeyPEBITCQATOZONX-UHFFFAOYSA-N
MW357.84 g/mol
LogP3.63
Rot. Bonds5

About 2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide

2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide (PubChem CID 54810281) has the molecular formula C19H20ClN3O2 and a molecular weight of 357.84 g/mol. Its IUPAC name is 2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide
PubChem CID54810281
Molecular FormulaC19H20ClN3O2
Molecular Weight357.84 g/mol
Exact Mass357.12
IUPAC Name2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide
SMILESO=C(CNc1ccc(Cl)cc1)Nc1ccc(C(=O)N2CCCC2)cc1
InChIInChI=1S/C19H20ClN3O2/c20-15-5-9-16(10-6-15)21-13-18(24)22-17-7-3-14(4-8-17)19(25)23-11-1-2-12-23/h3-10,21H,1-2,11-13H2,(H,22,24)
InChIKeyPEBITCQATOZONX-UHFFFAOYSA-N
XLogP3.63
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.84
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]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

2-anilino-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide;hydrochloride
CID 119702402
N-(3,4-dichlorophenyl)-2-[4-(pyrrolidine-1-carbonyl)anilino]acetamide
CID 54834153
2-[4-(azepane-1-carbonyl)anilino]-N-(4-bromophenyl)acetamide
CID 54834872
N-(4-fluorophenyl)-2-[4-(piperidine-1-carbonyl)anilino]acetamide
CID 54841618
2-[3-(azepane-1-carbonyl)anilino]-N-(4-chlorophenyl)acetamide
CID 54841635
2-(4-chlorophenyl)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 17173032
N-(2,5-dichlorophenyl)-2-[4-(piperidine-1-carbonyl)anilino]acetamide
CID 54841411
N-(5-chloro-2-methylphenyl)-2-[4-(piperidine-1-carbonyl)anilino]acetamide
CID 54841442
N-[4-[[2-[4-(azepane-1-carbonyl)anilino]-2-oxoethyl]amino]phenyl]butanamide
CID 54836878
N-(3,5-dimethylphenyl)-2-[4-(piperidine-1-carbonyl)anilino]acetamide
CID 54841740
N-(4-propan-2-yloxyphenyl)-2-[4-(pyrrolidine-1-carbonyl)anilino]acetamide
CID 54834060
2-[4-(azepane-1-carbonyl)anilino]-N-(2,3-dichlorophenyl)acetamide
CID 54834934

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide?
The IUPAC name of 2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide (CID 54810281) is 2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide.
What is the SMILES notation for 2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide?
The canonical SMILES for 2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide is O=C(CNc1ccc(Cl)cc1)Nc1ccc(C(=O)N2CCCC2)cc1.
What is the InChIKey of 2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide?
The InChIKey is PEBITCQATOZONX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O2/c20-15-5-9-16(10-6-15)21-13-18(24)22-17-7-3-14(4-8-17)19(25)23-11-1-2-12-23/h3-10,21H,1-2,11-13H2,(H,22,24).
What are the key properties of 2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide?
2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide has a molecular weight of 357.84 g/mol, XLogP of 3.63, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloroanilino)-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide is sourced from PubChem (CID 54810281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).