N-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide

C18H20F2N2O3 — CID 47062590

IUPACN-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide
SMILESCOCCn1cc(C(=O)NC(C)Cc2c(F)cccc2F)ccc1=O
InChIInChI=1S/C18H20F2N2O3/c1-12(10-14-15(19)4-3-5-16(14)20)21-18(24)13-6-7-17(23)22(11-13)8-9-25-2/h3-7,11-12H,8-10H2,1-2H3,(H,21,24)
InChIKeyKSIZWCRGEZQBBY-UHFFFAOYSA-N
MW350.37 g/mol
LogP2.13
Rot. Bonds7

About N-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide

N-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide (PubChem CID 47062590) has the molecular formula C18H20F2N2O3 and a molecular weight of 350.37 g/mol. Its IUPAC name is N-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide
PubChem CID47062590
Molecular FormulaC18H20F2N2O3
Molecular Weight350.37 g/mol
Exact Mass350.14
IUPAC NameN-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide
SMILESCOCCn1cc(C(=O)NC(C)Cc2c(F)cccc2F)ccc1=O
InChIInChI=1S/C18H20F2N2O3/c1-12(10-14-15(19)4-3-5-16(14)20)21-18(24)13-6-7-17(23)22(11-13)8-9-25-2/h3-7,11-12H,8-10H2,1-2H3,(H,21,24)
InChIKeyKSIZWCRGEZQBBY-UHFFFAOYSA-N
XLogP2.13
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.37
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2R)-1-(4-chlorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide
CID 94177179
1-(2-methoxyethyl)-N-(1-morpholin-4-ylpropan-2-yl)-6-oxopyridine-3-carboxamide
CID 55883209
N-[1-(3-chlorophenyl)propan-2-yl]-1-(2-ethoxyethyl)-6-oxopyridine-3-carboxamide
CID 178166100
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide
CID 94528338
1,3-bis[(2R)-1-(2,6-difluorophenyl)propan-2-yl]urea
CID 95141541
2-amino-N-[1-(2,6-difluorophenyl)propan-2-yl]-3-methoxypropanamide
CID 81083554
2-fluoro-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]benzamide
CID 38675455
1-(2-methoxyethyl)-N-[2-(2-methylphenyl)ethyl]-6-oxopyridine-3-carboxamide
CID 47059590
N-[2-(2,3-dichlorophenyl)ethyl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide
CID 47062519
N-[1-(2,6-difluorophenyl)propan-2-yl]-4-(ethylsulfamoyl)benzamide
CID 55861005
N-[1-(2,6-difluorophenyl)propan-2-yl]-1,1,3-trioxo-2-propan-2-yl-1,2-benzothiazole-6-carboxamide
CID 55876661
2-bromo-N-[1-(2,6-difluorophenyl)propan-2-yl]-2-methylpropanamide
CID 114328026

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide?
The IUPAC name of N-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide (CID 47062590) is N-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide.
What is the SMILES notation for N-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide?
The canonical SMILES for N-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide is COCCn1cc(C(=O)NC(C)Cc2c(F)cccc2F)ccc1=O.
What is the InChIKey of N-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide?
The InChIKey is KSIZWCRGEZQBBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20F2N2O3/c1-12(10-14-15(19)4-3-5-16(14)20)21-18(24)13-6-7-17(23)22(11-13)8-9-25-2/h3-7,11-12H,8-10H2,1-2H3,(H,21,24).
What are the key properties of N-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide?
N-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide has a molecular weight of 350.37 g/mol, XLogP of 2.13, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,6-difluorophenyl)propan-2-yl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 47062590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).