2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide

C17H24N2O3 — CID 18870129

IUPAC2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide
SMILESCC(C)C(=O)Nc1cccc(OCC(=O)N2CCCCC2)c1
InChIInChI=1S/C17H24N2O3/c1-13(2)17(21)18-14-7-6-8-15(11-14)22-12-16(20)19-9-4-3-5-10-19/h6-8,11,13H,3-5,9-10,12H2,1-2H3,(H,18,21)
InChIKeyXMQFSJOMBNRLIM-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.67
Rot. Bonds5

About 2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide

2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide (PubChem CID 18870129) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide
PubChem CID18870129
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide
SMILESCC(C)C(=O)Nc1cccc(OCC(=O)N2CCCCC2)c1
InChIInChI=1S/C17H24N2O3/c1-13(2)17(21)18-14-7-6-8-15(11-14)22-12-16(20)19-9-4-3-5-10-19/h6-8,11,13H,3-5,9-10,12H2,1-2H3,(H,18,21)
InChIKeyXMQFSJOMBNRLIM-UHFFFAOYSA-N
XLogP2.67
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-3,3-dimethyl-N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]butanamide
CID 119713860
2-naphthalen-1-yl-N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]acetamide
CID 46461055
4,4-dimethyl-N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]pentanamide
CID 129255718
2-methyl-N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]pent-2-enamide
CID 76868356
N-[3-[2-(cyclohexylamino)-2-oxoethoxy]phenyl]-2-methylpropanamide
CID 18870146
2-[3-[(1R)-1-aminoethyl]phenoxy]-1-pyrrolidin-1-ylethanone
CID 30118492
2-cyano-2-methyl-N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]propanamide
CID 60530152
5-amino-2-methyl-N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]benzamide
CID 120621130
3-amino-N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]-3-phenylpropanamide
CID 119949591
2-[3-(2-aminoethylamino)phenoxy]-1-pyrrolidin-1-ylethanone
CID 117097629
N-[3-[2-oxo-2-(4-oxopiperidin-1-yl)ethoxy]phenyl]acetamide
CID 62030068
2-[3-(2-aminopropyl)phenoxy]-1-(azepan-1-yl)ethanone
CID 60906670

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide?
The IUPAC name of 2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide (CID 18870129) is 2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide.
What is the SMILES notation for 2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide?
The canonical SMILES for 2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide is CC(C)C(=O)Nc1cccc(OCC(=O)N2CCCCC2)c1.
What is the InChIKey of 2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide?
The InChIKey is XMQFSJOMBNRLIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-13(2)17(21)18-14-7-6-8-15(11-14)22-12-16(20)19-9-4-3-5-10-19/h6-8,11,13H,3-5,9-10,12H2,1-2H3,(H,18,21).
What are the key properties of 2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide?
2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide has a molecular weight of 304.39 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[3-(2-oxo-2-piperidin-1-ylethoxy)phenyl]propanamide is sourced from PubChem (CID 18870129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).