N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide

C17H20N2O4 — CID 90624909

IUPACN-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)NCC(O)Cn2ccccc2=O)c1
InChIInChI=1S/C17H20N2O4/c1-13-5-4-6-15(9-13)23-12-16(21)18-10-14(20)11-19-8-3-2-7-17(19)22/h2-9,14,20H,10-12H2,1H3,(H,18,21)
InChIKeyGIKVAUKVNOTZAW-UHFFFAOYSA-N
MW316.36 g/mol
LogP0.71
Rot. Bonds7

About N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide

N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide (PubChem CID 90624909) has the molecular formula C17H20N2O4 and a molecular weight of 316.36 g/mol. Its IUPAC name is N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide
PubChem CID90624909
Molecular FormulaC17H20N2O4
Molecular Weight316.36 g/mol
Exact Mass316.14
IUPAC NameN-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)NCC(O)Cn2ccccc2=O)c1
InChIInChI=1S/C17H20N2O4/c1-13-5-4-6-15(9-13)23-12-16(21)18-10-14(20)11-19-8-3-2-7-17(19)22/h2-9,14,20H,10-12H2,1H3,(H,18,21)
InChIKeyGIKVAUKVNOTZAW-UHFFFAOYSA-N
XLogP0.71
TPSA80.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methoxyphenoxy)acetamide
CID 90624905
2-(4-fluorophenoxy)-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide
CID 90624911
N-(2,3-dihydroxypropyl)-2-(3-methylphenoxy)acetamide
CID 66177924
N-[(2S)-2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-phenylacetamide
CID 99903624
N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(3-methylphenoxy)acetamide
CID 111119904
4-chloro-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]butanamide
CID 90624845
2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]acetamide
CID 72719917
N-(3-amino-2-methylpropyl)-2-(3-methylphenoxy)acetamide
CID 119998062
N-[2-(methylamino)propyl]-2-(3-methylphenoxy)acetamide;hydrochloride
CID 120828955
1-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-3-propan-2-ylurea
CID 90625121
N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-pyrazol-1-ylacetamide
CID 90624986
2-(3-methylphenoxy)-N-[2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]acetamide;hydrochloride
CID 52985221

Frequently Asked Questions

What is the IUPAC name of N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide?
The IUPAC name of N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide (CID 90624909) is N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide.
What is the SMILES notation for N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide?
The canonical SMILES for N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide is Cc1cccc(OCC(=O)NCC(O)Cn2ccccc2=O)c1.
What is the InChIKey of N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide?
The InChIKey is GIKVAUKVNOTZAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4/c1-13-5-4-6-15(9-13)23-12-16(21)18-10-14(20)11-19-8-3-2-7-17(19)22/h2-9,14,20H,10-12H2,1H3,(H,18,21).
What are the key properties of N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide?
N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide has a molecular weight of 316.36 g/mol, XLogP of 0.71, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-2-(3-methylphenoxy)acetamide is sourced from PubChem (CID 90624909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).