2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide

C15H20N2O3 — CID 94219466

IUPAC2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide
SMILESCc1cccc(C)c1OCC(=O)N[C@@H]1CCCNC1=O
InChIInChI=1S/C15H20N2O3/c1-10-5-3-6-11(2)14(10)20-9-13(18)17-12-7-4-8-16-15(12)19/h3,5-6,12H,4,7-9H2,1-2H3,(H,16,19)(H,17,18)/t12-/m1/s1
InChIKeyUUGBOIMWXNQOGQ-GFCCVEGCSA-N
MW276.34 g/mol
LogP1.08
Rot. Bonds4

About 2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide

2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide (PubChem CID 94219466) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide.

Molecular Properties

Compound Name2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide
PubChem CID94219466
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide
SMILESCc1cccc(C)c1OCC(=O)N[C@@H]1CCCNC1=O
InChIInChI=1S/C15H20N2O3/c1-10-5-3-6-11(2)14(10)20-9-13(18)17-12-7-4-8-16-15(12)19/h3,5-6,12H,4,7-9H2,1-2H3,(H,16,19)(H,17,18)/t12-/m1/s1
InChIKeyUUGBOIMWXNQOGQ-GFCCVEGCSA-N
XLogP1.08
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methylphenoxy)-N-[(3S)-2-oxopiperidin-3-yl]acetamide
CID 94801293
3-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]azetidine-1-carboxamide
CID 125436263
2-(2-carbamothioylphenoxy)-N-(2-oxopiperidin-3-yl)acetamide
CID 62094351
N-(2-oxopiperidin-3-yl)butanamide
CID 62054699
2-(2,6-dimethylphenoxy)-N-(pyrrolidin-2-ylmethyl)acetamide
CID 119514519
N-[(3S)-2-oxopiperidin-3-yl]-2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetamide
CID 95048353
2-(3-aminophenyl)-N-(2-oxopiperidin-3-yl)acetamide
CID 62498386
N-(2,3-dimethylcyclohexyl)-2-(2,6-dimethylphenoxy)acetamide
CID 42989465
2-(2,6-dimethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide
CID 119464381
3-(3-fluorophenoxy)-N-[(3S)-2-oxopiperidin-3-yl]propanamide
CID 92568904
2-(2-methoxyethoxy)-N-(2-oxoazepan-3-yl)acetamide
CID 103614914
N-[2-(aminomethyl)cyclopentyl]-2-(2,6-dimethylphenoxy)acetamide
CID 119605033

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide?
The IUPAC name of 2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide (CID 94219466) is 2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide.
What is the SMILES notation for 2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide?
The canonical SMILES for 2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide is Cc1cccc(C)c1OCC(=O)N[C@@H]1CCCNC1=O.
What is the InChIKey of 2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide?
The InChIKey is UUGBOIMWXNQOGQ-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-10-5-3-6-11(2)14(10)20-9-13(18)17-12-7-4-8-16-15(12)19/h3,5-6,12H,4,7-9H2,1-2H3,(H,16,19)(H,17,18)/t12-/m1/s1.
What are the key properties of 2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide?
2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide has a molecular weight of 276.34 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylphenoxy)-N-[(3R)-2-oxopiperidin-3-yl]acetamide is sourced from PubChem (CID 94219466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).