N-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide

C14H18ClN3O2 — CID 115745385

IUPACN-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide
SMILESO=C(CNCC(=O)N1CCCC1)Nc1cccc(Cl)c1
InChIInChI=1S/C14H18ClN3O2/c15-11-4-3-5-12(8-11)17-13(19)9-16-10-14(20)18-6-1-2-7-18/h3-5,8,16H,1-2,6-7,9-10H2,(H,17,19)
InChIKeyICTAEYIUYYROSX-UHFFFAOYSA-N
MW295.77 g/mol
LogP1.49
Rot. Bonds5

About N-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide

N-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide (PubChem CID 115745385) has the molecular formula C14H18ClN3O2 and a molecular weight of 295.77 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide
PubChem CID115745385
Molecular FormulaC14H18ClN3O2
Molecular Weight295.77 g/mol
Exact Mass295.11
IUPAC NameN-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide
SMILESO=C(CNCC(=O)N1CCCC1)Nc1cccc(Cl)c1
InChIInChI=1S/C14H18ClN3O2/c15-11-4-3-5-12(8-11)17-13(19)9-16-10-14(20)18-6-1-2-7-18/h3-5,8,16H,1-2,6-7,9-10H2,(H,17,19)
InChIKeyICTAEYIUYYROSX-UHFFFAOYSA-N
XLogP1.49
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.77
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(azepan-1-yl)-N-(3-chlorophenyl)-3-oxopropanamide
CID 108952689
2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-N-(3-chlorophenyl)acetamide
CID 34905366
2-(3-chloroanilino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 47145291
N-(3-chlorophenyl)-2-(2-pyrrolidin-1-ylethylamino)acetamide
CID 55023239
1-(azepan-1-yl)-2-[2-(3-chlorophenyl)ethylamino]ethanone
CID 109006698
1-(aziridin-1-yl)-2-(3-chloroanilino)ethanone
CID 131042783
3-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-N-(3-chlorophenyl)propanamide
CID 55482910
N-(3-chlorophenyl)-2-(2,2-dimethylpropylamino)acetamide
CID 61168620
N-(3-chlorophenyl)-2-pyrrolidin-1-ylacetamide;hydrochloride
CID 2917131
N-(3-chlorophenyl)-3-morpholin-4-yl-3-oxopropanamide
CID 108943524
N-(3-chlorophenyl)-3-(4-methylpiperazin-1-yl)-3-oxopropanamide
CID 108944416
N-(3-chlorophenyl)-2-(4-pyrrolidin-1-ylanilino)acetamide
CID 109008455

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide (CID 115745385) is N-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide is O=C(CNCC(=O)N1CCCC1)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide?
The InChIKey is ICTAEYIUYYROSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClN3O2/c15-11-4-3-5-12(8-11)17-13(19)9-16-10-14(20)18-6-1-2-7-18/h3-5,8,16H,1-2,6-7,9-10H2,(H,17,19).
What are the key properties of N-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide?
N-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide has a molecular weight of 295.77 g/mol, XLogP of 1.49, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]acetamide is sourced from PubChem (CID 115745385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).