N,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide

C13H20N2O3 — CID 14956320

IUPACN,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide
SMILESCCN(CC)C(=O)CCn1ccc(=O)c(O)c1C
InChIInChI=1S/C13H20N2O3/c1-4-14(5-2)12(17)7-9-15-8-6-11(16)13(18)10(15)3/h6,8,18H,4-5,7,9H2,1-3H3
InChIKeyMSRILNGRHUCWAS-UHFFFAOYSA-N
MW252.31 g/mol
LogP1.12
Rot. Bonds5

About N,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide

N,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide (PubChem CID 14956320) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is N,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide.

Molecular Properties

Compound NameN,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide
PubChem CID14956320
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC NameN,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide
SMILESCCN(CC)C(=O)CCn1ccc(=O)c(O)c1C
InChIInChI=1S/C13H20N2O3/c1-4-14(5-2)12(17)7-9-15-8-6-11(16)13(18)10(15)3/h6,8,18H,4-5,7,9H2,1-3H3
InChIKeyMSRILNGRHUCWAS-UHFFFAOYSA-N
XLogP1.12
TPSA62.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

CP 94
CID 86322
3-Hydroxy-2-methyl-1-propyl-4(1H)-pyridone
CID 121732
3-Hydroxy-2-methyl-1-[3-[methyl(prop-2-ynyl)amino]propyl]pyridin-4-one
CID 162644991
2-Ethyl-3-hydroxy-1-propyl-4-pyridinone
CID 86321
3-(3-Hydroxy-2-methyl-4-oxo-1(4H)-pyridinyl)-N-propylpropanamide
CID 13336721
4(1H)-Pyridinone, 1-butyl-2-ethyl-3-hydroxy-
CID 14956305
N-Ethyl-3-hydroxy-2-methyl-4-oxo-1(4H)-pyridinepropanamide
CID 14956315
3-(3-Hydroxy-2-methyl-4-oxo-1(4H)-pyridinyl)-N-isopropylpropanamide
CID 14956316
N-Butyl-3-(3-hydroxy-2-methyl-4-oxopyridin-1(4H)-yl)propanamide
CID 14956317
4-Pyridinone,3-OH-2-Me-1-diMeAm-CO-Et-
CID 14956318
Propanamide, N-ethyl-3-(3-hydroxy-2-methyl-4-oxo
CID 14956319
4(1h)-Pyridinone,1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxy-
CID 24881318

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide?
The IUPAC name of N,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide (CID 14956320) is N,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide.
What is the SMILES notation for N,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide?
The canonical SMILES for N,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide is CCN(CC)C(=O)CCn1ccc(=O)c(O)c1C.
What is the InChIKey of N,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide?
The InChIKey is MSRILNGRHUCWAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-4-14(5-2)12(17)7-9-15-8-6-11(16)13(18)10(15)3/h6,8,18H,4-5,7,9H2,1-3H3.
What are the key properties of N,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide?
N,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide has a molecular weight of 252.31 g/mol, XLogP of 1.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide is sourced from PubChem (CID 14956320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).