5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide

C18H14Cl2N2O3 — CID 1231751

IUPAC5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(COc3cc(Cl)ccc3Cl)o2)nc1
InChIInChI=1S/C18H14Cl2N2O3/c1-11-2-7-17(21-9-11)22-18(23)15-6-4-13(25-15)10-24-16-8-12(19)3-5-14(16)20/h2-9H,10H2,1H3,(H,21,22,23)
InChIKeyHGQTWURFLNVEPH-UHFFFAOYSA-N
MW377.23 g/mol
LogP5.12
Rot. Bonds5

About 5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide

5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide (PubChem CID 1231751) has the molecular formula C18H14Cl2N2O3 and a molecular weight of 377.23 g/mol. Its IUPAC name is 5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide
PubChem CID1231751
Molecular FormulaC18H14Cl2N2O3
Molecular Weight377.23 g/mol
Exact Mass376.04
IUPAC Name5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(COc3cc(Cl)ccc3Cl)o2)nc1
InChIInChI=1S/C18H14Cl2N2O3/c1-11-2-7-17(21-9-11)22-18(23)15-6-4-13(25-15)10-24-16-8-12(19)3-5-14(16)20/h2-9H,10H2,1H3,(H,21,22,23)
InChIKeyHGQTWURFLNVEPH-UHFFFAOYSA-N
XLogP5.12
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.23
LogP ≤ 55.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-chloropyridin-2-yl)-1-benzofuran-2-carboxamide
CID 949440
5-[(4-chlorophenoxy)methyl]-N-(4-methyl-2-pyridinyl)-2-furamide
CID 725940
N-(3-methyl-2-pyridinyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 24239957
N-(5-methyl-2-pyridinyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 24243657
5-((2-Chlorophenoxy)methyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 717071
N-(5-chloropyridin-2-yl)-3-methyl-1-benzofuran-2-carboxamide
CID 738360
N-(5-chloro-2-pyridinyl)-5-[(2,2,3,3-tetrafluoropropoxy)methyl]-2-furamide
CID 1091771
5-[(2-chlorophenoxy)methyl]-N-(2-pyridinyl)-2-furamide
CID 1225502
5-[(2,4-dichlorophenoxy)methyl]-N-(6-methyl-2-pyridinyl)-2-furamide
CID 1269620
5-[(2-bromophenoxy)methyl]-N-(5-chloropyridin-2-yl)furan-2-carboxamide
CID 1269634
5-[(2,4-dichlorophenoxy)methyl]-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 2166402
N-(5-chloropyridin-2-yl)-1-benzofuran-2-carboxamide
CID 673886

Frequently Asked Questions

What is the IUPAC name of 5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide?
The IUPAC name of 5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide (CID 1231751) is 5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide.
What is the SMILES notation for 5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide?
The canonical SMILES for 5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide is Cc1ccc(NC(=O)c2ccc(COc3cc(Cl)ccc3Cl)o2)nc1.
What is the InChIKey of 5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide?
The InChIKey is HGQTWURFLNVEPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14Cl2N2O3/c1-11-2-7-17(21-9-11)22-18(23)15-6-4-13(25-15)10-24-16-8-12(19)3-5-14(16)20/h2-9H,10H2,1H3,(H,21,22,23).
What are the key properties of 5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide?
5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide has a molecular weight of 377.23 g/mol, XLogP of 5.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2,5-dichlorophenoxy)methyl]-N-(5-methyl-2-pyridinyl)furan-2-carboxamide is sourced from PubChem (CID 1231751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).