5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide

C19H15N3O4 — CID 47051131

IUPAC5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)cn1
InChIInChI=1S/C19H15N3O4/c1-24-18-9-6-14(11-21-18)22-19(23)17-8-7-15(26-17)12-25-16-5-3-2-4-13(16)10-20/h2-9,11H,12H2,1H3,(H,22,23)
InChIKeyPQTAXDHCGUQADQ-UHFFFAOYSA-N
MW349.35 g/mol
LogP3.39
Rot. Bonds6

About 5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide

5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide (PubChem CID 47051131) has the molecular formula C19H15N3O4 and a molecular weight of 349.35 g/mol. Its IUPAC name is 5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide
PubChem CID47051131
Molecular FormulaC19H15N3O4
Molecular Weight349.35 g/mol
Exact Mass349.11
IUPAC Name5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)cn1
InChIInChI=1S/C19H15N3O4/c1-24-18-9-6-14(11-21-18)22-19(23)17-8-7-15(26-17)12-25-16-5-3-2-4-13(16)10-20/h2-9,11H,12H2,1H3,(H,22,23)
InChIKeyPQTAXDHCGUQADQ-UHFFFAOYSA-N
XLogP3.39
TPSA97.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.35
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-[(2-cyanophenoxy)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)furan-2-carboxamide
CID 47051140
5-[(2-cyanophenoxy)methyl]-N-[4-(prop-2-enylcarbamoylamino)phenyl]furan-2-carboxamide
CID 55823378
N-(6-methoxy-3-pyridinyl)-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 33281766
5-[(2-cyanophenoxy)methyl]-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 51085773
N-(4-chloro-2-methylphenyl)-5-[(2-cyanophenoxy)methyl]furan-2-carboxamide
CID 55884416
5-[(2-cyanophenoxy)methyl]-N-[3-(cyclopropylmethoxymethyl)phenyl]furan-2-carboxamide
CID 48585316
N-(4-ethoxyphenyl)-5-[(2-methoxyphenoxy)methyl]furan-2-carboxamide
CID 19467513
N-(2-anilino-2-oxo-1-phenylethyl)-5-[(2-cyanophenoxy)methyl]furan-2-carboxamide
CID 55872708
5-[(2-methoxyphenoxy)methyl]-N-(3,4,5-trimethoxyphenyl)furan-2-carboxamide
CID 3153929
5-[(2-cyanophenoxy)methyl]-N-methyl-N-propan-2-ylfuran-2-carboxamide
CID 87024322
5-[(2-cyanophenoxy)methyl]-N-[3-(5-methylsulfanyltetrazol-1-yl)phenyl]furan-2-carboxamide
CID 55871417
N-(6-methoxy-3-pyridinyl)-5-nitrofuran-2-carboxamide
CID 51143054

Frequently Asked Questions

What is the IUPAC name of 5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide?
The IUPAC name of 5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide (CID 47051131) is 5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide.
What is the SMILES notation for 5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide?
The canonical SMILES for 5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide is COc1ccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)cn1.
What is the InChIKey of 5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide?
The InChIKey is PQTAXDHCGUQADQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O4/c1-24-18-9-6-14(11-21-18)22-19(23)17-8-7-15(26-17)12-25-16-5-3-2-4-13(16)10-20/h2-9,11H,12H2,1H3,(H,22,23).
What are the key properties of 5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide?
5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide has a molecular weight of 349.35 g/mol, XLogP of 3.39, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-cyanophenoxy)methyl]-N-(6-methoxy-3-pyridinyl)furan-2-carboxamide is sourced from PubChem (CID 47051131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).