2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide

C14H19N3O2 — CID 19705544

IUPAC2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide
SMILESNC(=O)CC1CCN(CC(=O)Nc2ccccc2)C1
InChIInChI=1S/C14H19N3O2/c15-13(18)8-11-6-7-17(9-11)10-14(19)16-12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H2,15,18)(H,16,19)
InChIKeyQKPUUARDRCXPNA-UHFFFAOYSA-N
MW261.32 g/mol
LogP0.82
Rot. Bonds5

About 2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide

2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide (PubChem CID 19705544) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide.

Molecular Properties

Compound Name2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide
PubChem CID19705544
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide
SMILESNC(=O)CC1CCN(CC(=O)Nc2ccccc2)C1
InChIInChI=1S/C14H19N3O2/c15-13(18)8-11-6-7-17(9-11)10-14(19)16-12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H2,15,18)(H,16,19)
InChIKeyQKPUUARDRCXPNA-UHFFFAOYSA-N
XLogP0.82
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(fluoromethyl)piperidin-1-yl]-N-phenylacetamide
CID 171690935
2-(4-hydroxypiperidin-1-yl)-N-phenylacetamide
CID 39902294
1-(2-anilino-2-oxoethyl)-N-phenylpiperidine-3-carboxamide
CID 17496230
2-[3-[(cyclopropylamino)methyl]piperidin-1-yl]-N-phenylacetamide
CID 63847086
2-[3-(hydroxymethyl)pyrrolidin-1-yl]-N-(4-methylphenyl)acetamide
CID 62372251
2-[4-(hydroxymethyl)piperidin-1-yl]-N-(4-phenylphenyl)acetamide
CID 60510320
2-[3-(aminomethyl)pyrrolidin-1-yl]-N-(3-chlorophenyl)acetamide;hydrochloride
CID 119918098
2-[1-[2-(4-carbamoylanilino)-2-oxoethyl]azetidin-3-yl]acetic acid
CID 64618914
2-(4-cyanopiperidin-1-yl)-N-phenylacetamide
CID 48940732
(3R)-1-[2-oxo-2-(4-phenylanilino)ethyl]piperidine-3-carboxamide
CID 9306022
2-[1-[2-(3-chloroanilino)-2-oxoethyl]piperidin-4-yl]acetic acid
CID 79611325
2-[3-(aminomethyl)pyrrolidin-1-yl]-N-(3-cyanophenyl)acetamide
CID 62062180

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide?
The IUPAC name of 2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide (CID 19705544) is 2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide.
What is the SMILES notation for 2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide?
The canonical SMILES for 2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide is NC(=O)CC1CCN(CC(=O)Nc2ccccc2)C1.
What is the InChIKey of 2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide?
The InChIKey is QKPUUARDRCXPNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c15-13(18)8-11-6-7-17(9-11)10-14(19)16-12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H2,15,18)(H,16,19).
What are the key properties of 2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide?
2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide has a molecular weight of 261.32 g/mol, XLogP of 0.82, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-anilino-2-oxoethyl)pyrrolidin-3-yl]acetamide is sourced from PubChem (CID 19705544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).