2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide

C15H21N3O2 — CID 115597732

IUPAC2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
SMILESNc1ccccc1CC(=O)NCC(=O)N1CCCCC1
InChIInChI=1S/C15H21N3O2/c16-13-7-3-2-6-12(13)10-14(19)17-11-15(20)18-8-4-1-5-9-18/h2-3,6-7H,1,4-5,8-11,16H2,(H,17,19)
InChIKeyJPKFNGMPAVRHEQ-UHFFFAOYSA-N
MW275.35 g/mol
LogP0.94
Rot. Bonds4

About 2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide

2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide (PubChem CID 115597732) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide.

Molecular Properties

Compound Name2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
PubChem CID115597732
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
SMILESNc1ccccc1CC(=O)NCC(=O)N1CCCCC1
InChIInChI=1S/C15H21N3O2/c16-13-7-3-2-6-12(13)10-14(19)17-11-15(20)18-8-4-1-5-9-18/h2-3,6-7H,1,4-5,8-11,16H2,(H,17,19)
InChIKeyJPKFNGMPAVRHEQ-UHFFFAOYSA-N
XLogP0.94
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(2-chlorophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
CID 110712323
N-[2-(azepan-1-yl)-2-oxoethyl]-2-naphthalen-1-ylacetamide
CID 7964073
2-(2-bromophenyl)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 112990865
2-(4-bromophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
CID 110712327
2-amino-6-chloro-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzamide
CID 70334221
2-(3-bromophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide
CID 112990956
[2-(azepan-1-yl)-2-oxoethyl] 2-[(2-naphthalen-1-ylacetyl)amino]acetate
CID 8574012
N-(2-oxo-2-pyrrolidin-1-ylethyl)-2-thiophen-2-ylacetamide
CID 47143342
methyl 2-[[2-(2-aminophenyl)acetyl]amino]acetate
CID 16773515
2-(2-aminophenyl)-N-prop-2-ynylacetamide
CID 61118028
1-[2-(azepan-1-yl)-2-oxoethyl]-3-phenylurea
CID 24583495
N-[2-(3-aminopiperidin-1-yl)-2-oxoethyl]-2-naphthalen-1-ylacetamide
CID 119379657

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide?
The IUPAC name of 2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide (CID 115597732) is 2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide.
What is the SMILES notation for 2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide?
The canonical SMILES for 2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide is Nc1ccccc1CC(=O)NCC(=O)N1CCCCC1.
What is the InChIKey of 2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide?
The InChIKey is JPKFNGMPAVRHEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c16-13-7-3-2-6-12(13)10-14(19)17-11-15(20)18-8-4-1-5-9-18/h2-3,6-7H,1,4-5,8-11,16H2,(H,17,19).
What are the key properties of 2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide?
2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide has a molecular weight of 275.35 g/mol, XLogP of 0.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)-N-(2-oxo-2-piperidin-1-ylethyl)acetamide is sourced from PubChem (CID 115597732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).