5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide

C17H13ClN2O3 — CID 1225502

IUPAC5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide
SMILESO=C(Nc1ccccn1)c1ccc(COc2ccccc2Cl)o1
InChIInChI=1S/C17H13ClN2O3/c18-13-5-1-2-6-14(13)22-11-12-8-9-15(23-12)17(21)20-16-7-3-4-10-19-16/h1-10H,11H2,(H,19,20,21)
InChIKeyIKBRIUULMFEPOR-UHFFFAOYSA-N
MW328.75 g/mol
LogP4.16
Rot. Bonds5

About 5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide

5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide (PubChem CID 1225502) has the molecular formula C17H13ClN2O3 and a molecular weight of 328.75 g/mol. Its IUPAC name is 5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide.

Molecular Properties

Compound Name5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide
PubChem CID1225502
Molecular FormulaC17H13ClN2O3
Molecular Weight328.75 g/mol
Exact Mass328.06
IUPAC Name5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide
SMILESO=C(Nc1ccccn1)c1ccc(COc2ccccc2Cl)o1
InChIInChI=1S/C17H13ClN2O3/c18-13-5-1-2-6-14(13)22-11-12-8-9-15(23-12)17(21)20-16-7-3-4-10-19-16/h1-10H,11H2,(H,19,20,21)
InChIKeyIKBRIUULMFEPOR-UHFFFAOYSA-N
XLogP4.16
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.75
LogP ≤ 54.16
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
2-[(5-Chloropyridin-2-yl)amino]-2-oxoethyl 2-furoate
CID 2586389
[1-[(5-Chloro-2-pyridinyl)amino]-1-oxopropan-2-yl] furan-2-carboxylate
CID 3433652
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
5-[(4-chlorophenoxy)methyl]-N-(2-pyridinylmethyl)-2-furamide
CID 726955
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-[(2,4-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

Frequently Asked Questions

What is the IUPAC name of 5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide?
The IUPAC name of 5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide (CID 1225502) is 5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide.
What is the SMILES notation for 5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide?
The canonical SMILES for 5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide is O=C(Nc1ccccn1)c1ccc(COc2ccccc2Cl)o1.
What is the InChIKey of 5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide?
The InChIKey is IKBRIUULMFEPOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClN2O3/c18-13-5-1-2-6-14(13)22-11-12-8-9-15(23-12)17(21)20-16-7-3-4-10-19-16/h1-10H,11H2,(H,19,20,21).
What are the key properties of 5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide?
5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide has a molecular weight of 328.75 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-chlorophenoxy)methyl]-N-pyridin-2-ylfuran-2-carboxamide is sourced from PubChem (CID 1225502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).