1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide

C19H17ClN2O3 — CID 18111836

IUPAC1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide
SMILESCN(Cc1ccco1)C(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1
InChIInChI=1S/C19H17ClN2O3/c1-21(13-16-6-4-10-25-16)19(24)15-8-9-18(23)22(12-15)11-14-5-2-3-7-17(14)20/h2-10,12H,11,13H2,1H3
InChIKeyJKBMTDZQEORXED-UHFFFAOYSA-N
MW356.81 g/mol
LogP3.42
Rot. Bonds5

About 1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide

1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide (PubChem CID 18111836) has the molecular formula C19H17ClN2O3 and a molecular weight of 356.81 g/mol. Its IUPAC name is 1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide
PubChem CID18111836
Molecular FormulaC19H17ClN2O3
Molecular Weight356.81 g/mol
Exact Mass356.09
IUPAC Name1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide
SMILESCN(Cc1ccco1)C(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1
InChIInChI=1S/C19H17ClN2O3/c1-21(13-16-6-4-10-25-16)19(24)15-8-9-18(23)22(12-15)11-14-5-2-3-7-17(14)20/h2-10,12H,11,13H2,1H3
InChIKeyJKBMTDZQEORXED-UHFFFAOYSA-N
XLogP3.42
TPSA55.45 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.81
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(2-chlorophenyl)methyl]-N-[(2-methoxyphenyl)methyl]-N-methyl-6-oxopyridine-3-carboxamide
CID 31234686
1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methylpyrazole-4-carboxamide
CID 38077636
1-[(2-chlorophenyl)methyl]-N-methyl-6-oxo-N-phenylpyridine-3-carboxamide
CID 24559383
1-[(2-chlorophenyl)methyl]-N-methyl-N-(1-methylcyclobutyl)-6-oxopyridine-3-carboxamide
CID 166315489
1-[(2-chlorophenyl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide
CID 42886096
1-[(2-chlorophenyl)methyl]-6-oxo-N-(2-phenylethyl)pyridine-3-carboxamide
CID 16573910
1-[(2-chlorophenyl)methyl]-N-[2-[cyclopropyl(methyl)amino]ethyl]-6-oxopyridine-3-carboxamide
CID 167967928
N'-benzoyl-1-[(2-chlorophenyl)methyl]-6-oxopyridine-3-carbohydrazide
CID 24546266
2-amino-6-chloro-N-(furan-2-ylmethyl)-N-methylbenzamide
CID 55246430
3-[[1-[(2-chlorophenyl)methyl]-6-oxopyridine-3-carbonyl]-cyclopropylamino]-2-methylpropanoic acid
CID 120535358
1-[(2-chlorophenyl)methyl]-N-[3-(dimethylcarbamoyl)phenyl]-6-oxopyridine-3-carboxamide
CID 30387044
1-[(2-chlorophenyl)methyl]-N-[2-(methylamino)propyl]-6-oxopyridine-3-carboxamide
CID 120827036

Frequently Asked Questions

What is the IUPAC name of 1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide?
The IUPAC name of 1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide (CID 18111836) is 1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for 1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide is CN(Cc1ccco1)C(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1.
What is the InChIKey of 1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide?
The InChIKey is JKBMTDZQEORXED-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O3/c1-21(13-16-6-4-10-25-16)19(24)15-8-9-18(23)22(12-15)11-14-5-2-3-7-17(14)20/h2-10,12H,11,13H2,1H3.
What are the key properties of 1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide?
1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide has a molecular weight of 356.81 g/mol, XLogP of 3.42, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-chlorophenyl)methyl]-N-(furan-2-ylmethyl)-N-methyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 18111836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).