N-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide

C18H13ClFN3O2 — CID 6488649

IUPACN-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide
SMILESO=C(Nc1cccn(Cc2c(F)cccc2Cl)c1=O)c1cccnc1
InChIInChI=1S/C18H13ClFN3O2/c19-14-5-1-6-15(20)13(14)11-23-9-3-7-16(18(23)25)22-17(24)12-4-2-8-21-10-12/h1-10H,11H2,(H,22,24)
InChIKeyCTUYPCLWHMCNEW-UHFFFAOYSA-N
MW357.77 g/mol
LogP3.34
Rot. Bonds4

About N-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide

N-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide (PubChem CID 6488649) has the molecular formula C18H13ClFN3O2 and a molecular weight of 357.77 g/mol. Its IUPAC name is N-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide
PubChem CID6488649
Molecular FormulaC18H13ClFN3O2
Molecular Weight357.77 g/mol
Exact Mass357.07
IUPAC NameN-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide
SMILESO=C(Nc1cccn(Cc2c(F)cccc2Cl)c1=O)c1cccnc1
InChIInChI=1S/C18H13ClFN3O2/c19-14-5-1-6-15(20)13(14)11-23-9-3-7-16(18(23)25)22-17(24)12-4-2-8-21-10-12/h1-10H,11H2,(H,22,24)
InChIKeyCTUYPCLWHMCNEW-UHFFFAOYSA-N
XLogP3.34
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.77
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(2-chloro-6-fluorophenyl)methyl]-N-(3,4-difluorophenyl)-2-oxopyridine-3-carboxamide
CID 7598199
1-[(2-chloro-6-fluorophenyl)methyl]-N-(6-methyl-2-pyridinyl)-2-oxopyridine-3-carboxamide
CID 7598234
1-[(2-chloro-6-fluorophenyl)methyl]-N-(2-methylquinolin-4-yl)-2-oxopyridine-3-carboxamide
CID 18582557
N-(3-chloro-2-methylphenyl)pyridine-3-carboxamide;hydrochloride
CID 110756419
8-[(2-chloro-6-fluorophenyl)methyl]-3-(pyridin-3-ylmethyl)pyrido[2,3-d]pyrimidine-2,4-dione
CID 56725529
3-chloro-1-[(2-chloro-6-fluorophenyl)methyl]pyrazin-2-one
CID 114561600
N-[1-[(2-chlorophenyl)methyl]-2-oxo-3-pyridinyl]-3-methoxybenzamide
CID 52949168
1-[(2-chloro-6-fluorophenyl)methyl]-N-(2-ethylphenyl)-6-oxopyridine-3-carboxamide
CID 26843899
2,2,2-trifluoroethyl N-[1-[(2,6-dichlorophenyl)methyl]-2-oxo-3-pyridinyl]carbamate
CID 3480406
N-(4-chloro-2-pyrazol-1-ylphenyl)pyridine-3-carboxamide
CID 99833805
1-[(2-chlorophenyl)methyl]-2-oxo-N-pyridin-3-ylpyridine-3-carboxamide
CID 7598532
N-naphthalen-1-ylpyridine-3-carboxamide
CID 532824

Frequently Asked Questions

What is the IUPAC name of N-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide?
The IUPAC name of N-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide (CID 6488649) is N-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide?
The canonical SMILES for N-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide is O=C(Nc1cccn(Cc2c(F)cccc2Cl)c1=O)c1cccnc1.
What is the InChIKey of N-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide?
The InChIKey is CTUYPCLWHMCNEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13ClFN3O2/c19-14-5-1-6-15(20)13(14)11-23-9-3-7-16(18(23)25)22-17(24)12-4-2-8-21-10-12/h1-10H,11H2,(H,22,24).
What are the key properties of N-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide?
N-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide has a molecular weight of 357.77 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(2-chloro-6-fluorophenyl)methyl]-2-oxo-3-pyridinyl]pyridine-3-carboxamide is sourced from PubChem (CID 6488649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).