N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide

C18H17N3O4 — CID 113020021

IUPACN-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide
SMILESCOc1ccc(Nc2ccc(NC(=O)c3ccco3)cn2)c(OC)c1
InChIInChI=1S/C18H17N3O4/c1-23-13-6-7-14(16(10-13)24-2)21-17-8-5-12(11-19-17)20-18(22)15-4-3-9-25-15/h3-11H,1-2H3,(H,19,21)(H,20,22)
InChIKeyLRRVISRSWUVSAH-UHFFFAOYSA-N
MW339.35 g/mol
LogP3.69
Rot. Bonds6

About N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide

N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide (PubChem CID 113020021) has the molecular formula C18H17N3O4 and a molecular weight of 339.35 g/mol. Its IUPAC name is N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide
PubChem CID113020021
Molecular FormulaC18H17N3O4
Molecular Weight339.35 g/mol
Exact Mass339.12
IUPAC NameN-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide
SMILESCOc1ccc(Nc2ccc(NC(=O)c3ccco3)cn2)c(OC)c1
InChIInChI=1S/C18H17N3O4/c1-23-13-6-7-14(16(10-13)24-2)21-17-8-5-12(11-19-17)20-18(22)15-4-3-9-25-15/h3-11H,1-2H3,(H,19,21)(H,20,22)
InChIKeyLRRVISRSWUVSAH-UHFFFAOYSA-N
XLogP3.69
TPSA85.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.35
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]acetamide
CID 113020010
N-[6-(3,4-dimethylanilino)-3-pyridinyl]furan-2-carboxamide
CID 113016955
N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]oxane-4-carboxamide
CID 113020060
N-[6-(3-acetamidoanilino)-3-pyridinyl]furan-2-carboxamide
CID 113020477
N-[5-(2,4-dimethoxyanilino)-2-pyridinyl]-3-methoxybenzamide
CID 113034694
N-[2-[(2,4-dimethoxybenzoyl)amino]phenyl]furan-2-carboxamide
CID 1026612
1-[5-(2,4-dimethoxyanilino)-2-pyridinyl]-3-phenylurea
CID 113034717
N-[5-(2,4-dimethoxyanilino)-2-pyridinyl]-2,2-dimethylpropanamide
CID 113034682
N-[6-(3-fluoroanilino)-3-pyridinyl]furan-2-carboxamide
CID 113021264
5-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109199779
2,6-dimethoxy-N-[6-(4-methoxyanilino)-3-pyridinyl]benzamide
CID 113019504
N-[6-(quinolin-8-ylamino)-3-pyridinyl]furan-2-carboxamide
CID 113021727

Frequently Asked Questions

What is the IUPAC name of N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide?
The IUPAC name of N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide (CID 113020021) is N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide.
What is the SMILES notation for N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide?
The canonical SMILES for N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide is COc1ccc(Nc2ccc(NC(=O)c3ccco3)cn2)c(OC)c1.
What is the InChIKey of N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide?
The InChIKey is LRRVISRSWUVSAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O4/c1-23-13-6-7-14(16(10-13)24-2)21-17-8-5-12(11-19-17)20-18(22)15-4-3-9-25-15/h3-11H,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide?
N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide has a molecular weight of 339.35 g/mol, XLogP of 3.69, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2,4-dimethoxyanilino)-3-pyridinyl]furan-2-carboxamide is sourced from PubChem (CID 113020021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).