5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide

C10H13ClN2O2 — CID 110855176

IUPAC5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1cc(Cl)c[nH]c1=O
InChIInChI=1S/C10H13ClN2O2/c1-3-13(4-2)10(15)8-5-7(11)6-12-9(8)14/h5-6H,3-4H2,1-2H3,(H,12,14)
InChIKeyMGARMAZDPYVZCL-UHFFFAOYSA-N
MW228.68 g/mol
LogP1.51
Rot. Bonds3

About 5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide

5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 110855176) has the molecular formula C10H13ClN2O2 and a molecular weight of 228.68 g/mol. Its IUPAC name is 5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID110855176
Molecular FormulaC10H13ClN2O2
Molecular Weight228.68 g/mol
Exact Mass228.07
IUPAC Name5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1cc(Cl)c[nH]c1=O
InChIInChI=1S/C10H13ClN2O2/c1-3-13(4-2)10(15)8-5-7(11)6-12-9(8)14/h5-6H,3-4H2,1-2H3,(H,12,14)
InChIKeyMGARMAZDPYVZCL-UHFFFAOYSA-N
XLogP1.51
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.68
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-2-oxo-1H-pyridine-3-carbonyl chloride
CID 45081691
4,5-dichloro-1-N,1-N,2-N,2-N-tetraethylbenzene-1,2-dicarboxamide
CID 23857395
3,5-dichloro-N,N-diethyl-2-formylbenzamide
CID 82544303
N,N-diethyl-7,7-dimethyl-2,5-dioxo-6,8-dihydro-1H-quinoline-3-carboxamide
CID 66495491
2-amino-4-chloro-N,N-diethylbenzamide
CID 16773722
3,4,5-trichloro-N,N-diethylbenzamide
CID 50849492
5-chloro-N-[(3-methylphenyl)methyl]-2-oxo-1H-pyridine-3-carboxamide
CID 110850809
N-[(4aR,6R,7aR)-3-oxo-1,2,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridin-6-yl]-5-chloro-N-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 135112274
6-(4-chloro-3-pyridinyl)-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide
CID 125478399
N-[(3-chlorophenyl)methyl]-N-ethyl-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 103717535
5-chloro-N-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
CID 125446087
N,N-diethyl-2,5-dioxo-7-phenyl-1,6,7,8-tetrahydroquinoline-3-carboxamide
CID 66495470

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide (CID 110855176) is 5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide is CCN(CC)C(=O)c1cc(Cl)c[nH]c1=O.
What is the InChIKey of 5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is MGARMAZDPYVZCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O2/c1-3-13(4-2)10(15)8-5-7(11)6-12-9(8)14/h5-6H,3-4H2,1-2H3,(H,12,14).
What are the key properties of 5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide?
5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 228.68 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N,N-diethyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 110855176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).