N-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide

C18H15N3O4 — CID 834436

IUPACN-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2ccco2)cc1NC(=O)c1cccnc1
InChIInChI=1S/C18H15N3O4/c1-24-15-7-6-13(20-18(23)16-5-3-9-25-16)10-14(15)21-17(22)12-4-2-8-19-11-12/h2-11H,1H3,(H,20,23)(H,21,22)
InChIKeyBIPKHPABEZEMMY-UHFFFAOYSA-N
MW337.34 g/mol
LogP3.19
Rot. Bonds5

About N-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide

N-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide (PubChem CID 834436) has the molecular formula C18H15N3O4 and a molecular weight of 337.34 g/mol. Its IUPAC name is N-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide
PubChem CID834436
Molecular FormulaC18H15N3O4
Molecular Weight337.34 g/mol
Exact Mass337.11
IUPAC NameN-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2ccco2)cc1NC(=O)c1cccnc1
InChIInChI=1S/C18H15N3O4/c1-24-15-7-6-13(20-18(23)16-5-3-9-25-16)10-14(15)21-17(22)12-4-2-8-19-11-12/h2-11H,1H3,(H,20,23)(H,21,22)
InChIKeyBIPKHPABEZEMMY-UHFFFAOYSA-N
XLogP3.19
TPSA93.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.34
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide?
The IUPAC name of N-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide (CID 834436) is N-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide is COc1ccc(NC(=O)c2ccco2)cc1NC(=O)c1cccnc1.
What is the InChIKey of N-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide?
The InChIKey is BIPKHPABEZEMMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O4/c1-24-15-7-6-13(20-18(23)16-5-3-9-25-16)10-14(15)21-17(22)12-4-2-8-19-11-12/h2-11H,1H3,(H,20,23)(H,21,22).
What are the key properties of N-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide?
N-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide has a molecular weight of 337.34 g/mol, XLogP of 3.19, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(furan-2-carbonylamino)-2-methoxyphenyl]pyridine-3-carboxamide is sourced from PubChem (CID 834436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).