N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide

C18H18F2N2O3 — CID 75393613

IUPACN-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide
SMILESCc1[nH]c(=O)ccc1C(=O)NC1(c2ccc(F)cc2F)CCOCC1
InChIInChI=1S/C18H18F2N2O3/c1-11-13(3-5-16(23)21-11)17(24)22-18(6-8-25-9-7-18)14-4-2-12(19)10-15(14)20/h2-5,10H,6-9H2,1H3,(H,21,23)(H,22,24)
InChIKeyLAYPYIIKGWIOST-UHFFFAOYSA-N
MW348.35 g/mol
LogP2.40
Rot. Bonds3

About N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide

N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 75393613) has the molecular formula C18H18F2N2O3 and a molecular weight of 348.35 g/mol. Its IUPAC name is N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide
PubChem CID75393613
Molecular FormulaC18H18F2N2O3
Molecular Weight348.35 g/mol
Exact Mass348.13
IUPAC NameN-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide
SMILESCc1[nH]c(=O)ccc1C(=O)NC1(c2ccc(F)cc2F)CCOCC1
InChIInChI=1S/C18H18F2N2O3/c1-11-13(3-5-16(23)21-11)17(24)22-18(6-8-25-9-7-18)14-4-2-12(19)10-15(14)20/h2-5,10H,6-9H2,1H3,(H,21,23)(H,22,24)
InChIKeyLAYPYIIKGWIOST-UHFFFAOYSA-N
XLogP2.40
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.35
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-1H-pyrrole-3-carboxamide
CID 75393612
N-[4-(2,4-difluorophenyl)oxan-4-yl]-5-methylfuran-3-carboxamide
CID 136534009
(2R)-N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-hydroxy-2-phenylacetamide
CID 97248230
N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 71993748
3-cyano-N-[4-(2,4-difluorophenyl)oxan-4-yl]benzamide
CID 75392620
N-[1-(2,4-difluorophenyl)cyclohexyl]-5-methyl-1,3-oxazole-4-carboxamide
CID 127701866
2-[3-[[4-(2,4-difluorophenyl)oxan-4-yl]amino]-3-oxopropyl]benzoic acid
CID 120551325
1-[4-(2,4-difluorophenyl)oxan-4-yl]-3-(1H-indol-6-yl)urea
CID 126785654
N-[4-(2,4-difluorophenyl)oxan-4-yl]-4-fluoro-2-methylbenzenesulfonamide
CID 99589179
2-bromo-4-fluoro-N-(4-methyloxan-4-yl)benzamide
CID 113322134
N-[4-(2,4-difluorophenyl)oxan-4-yl]-3-[(2S)-oxolan-2-yl]propanamide
CID 97083131
4-(2,4-difluorophenyl)oxane-4-carboxylic acid
CID 64561177

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide (CID 75393613) is N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide is Cc1[nH]c(=O)ccc1C(=O)NC1(c2ccc(F)cc2F)CCOCC1.
What is the InChIKey of N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is LAYPYIIKGWIOST-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F2N2O3/c1-11-13(3-5-16(23)21-11)17(24)22-18(6-8-25-9-7-18)14-4-2-12(19)10-15(14)20/h2-5,10H,6-9H2,1H3,(H,21,23)(H,22,24).
What are the key properties of N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide?
N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 348.35 g/mol, XLogP of 2.40, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,4-difluorophenyl)oxan-4-yl]-2-methyl-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 75393613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).