6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide

C22H19N3O2 — CID 46349002

IUPAC6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide
SMILESCc1ccc2nc(-c3ccccn3)cc(C(=O)NCc3ccc(C)o3)c2c1
InChIInChI=1S/C22H19N3O2/c1-14-6-9-19-17(11-14)18(12-21(25-19)20-5-3-4-10-23-20)22(26)24-13-16-8-7-15(2)27-16/h3-12H,13H2,1-2H3,(H,24,26)
InChIKeySBXUKHPTLQYAND-UHFFFAOYSA-N
MW357.41 g/mol
LogP4.44
Rot. Bonds4

About 6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide

6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide (PubChem CID 46349002) has the molecular formula C22H19N3O2 and a molecular weight of 357.41 g/mol. Its IUPAC name is 6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide.

Molecular Properties

Compound Name6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide
PubChem CID46349002
Molecular FormulaC22H19N3O2
Molecular Weight357.41 g/mol
Exact Mass357.15
IUPAC Name6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide
SMILESCc1ccc2nc(-c3ccccn3)cc(C(=O)NCc3ccc(C)o3)c2c1
InChIInChI=1S/C22H19N3O2/c1-14-6-9-19-17(11-14)18(12-21(25-19)20-5-3-4-10-23-20)22(26)24-13-16-8-7-15(2)27-16/h3-12H,13H2,1-2H3,(H,24,26)
InChIKeySBXUKHPTLQYAND-UHFFFAOYSA-N
XLogP4.44
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.41
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-dimethyl-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide
CID 18107562
N-ethyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 17473754
N-[(2S)-3,3-dimethylbutan-2-yl]-6-methyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 899137
2-amino-5-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 62523939
N-[(2-chlorophenyl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide
CID 3611934
N-[4-[5-(acetamidomethyl)furan-2-yl]-1,3-thiazol-2-yl]-2-pyridin-2-ylquinoline-4-carboxamide
CID 43036587
N-[2-(4-benzylpiperidin-1-yl)ethyl]-6-methyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 20964871
2-(3-methoxyphenyl)-6-methyl-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide
CID 42750059
N-[2-(5-methyl-1H-indol-3-yl)ethyl]-2-pyridin-2-ylquinoline-4-carboxamide
CID 50798360
2-(2,4-dimethoxyphenyl)-N-(furan-2-ylmethyl)-6-methylquinoline-4-carboxamide
CID 42749987
2-(4-methylphenyl)-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide
CID 1220288
2,6,8-trimethyl-N-[(3-pyridin-2-yl-1,2-oxazol-5-yl)methyl]quinoline-4-carboxamide
CID 70750036

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide?
The IUPAC name of 6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide (CID 46349002) is 6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide.
What is the SMILES notation for 6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide?
The canonical SMILES for 6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide is Cc1ccc2nc(-c3ccccn3)cc(C(=O)NCc3ccc(C)o3)c2c1.
What is the InChIKey of 6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide?
The InChIKey is SBXUKHPTLQYAND-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O2/c1-14-6-9-19-17(11-14)18(12-21(25-19)20-5-3-4-10-23-20)22(26)24-13-16-8-7-15(2)27-16/h3-12H,13H2,1-2H3,(H,24,26).
What are the key properties of 6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide?
6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide has a molecular weight of 357.41 g/mol, XLogP of 4.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-[(5-methylfuran-2-yl)methyl]-2-pyridin-2-ylquinoline-4-carboxamide is sourced from PubChem (CID 46349002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).