N-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide

C20H18N2O3 — CID 46948065

IUPACN-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide
SMILESCC1(C(=O)NCc2ccco2)Cc2c(-c3ccccc3)ccnc2O1
InChIInChI=1S/C20H18N2O3/c1-20(19(23)22-13-15-8-5-11-24-15)12-17-16(9-10-21-18(17)25-20)14-6-3-2-4-7-14/h2-11H,12-13H2,1H3,(H,22,23)
InChIKeyFBKQJHNGKURAPA-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.35
Rot. Bonds4

About N-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide

N-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide (PubChem CID 46948065) has the molecular formula C20H18N2O3 and a molecular weight of 334.38 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide
PubChem CID46948065
Molecular FormulaC20H18N2O3
Molecular Weight334.38 g/mol
Exact Mass334.13
IUPAC NameN-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide
SMILESCC1(C(=O)NCc2ccco2)Cc2c(-c3ccccc3)ccnc2O1
InChIInChI=1S/C20H18N2O3/c1-20(19(23)22-13-15-8-5-11-24-15)12-17-16(9-10-21-18(17)25-20)14-6-3-2-4-7-14/h2-11H,12-13H2,1H3,(H,22,23)
InChIKeyFBKQJHNGKURAPA-UHFFFAOYSA-N
XLogP3.35
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide (CID 46948065) is N-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide is CC1(C(=O)NCc2ccco2)Cc2c(-c3ccccc3)ccnc2O1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide?
The InChIKey is FBKQJHNGKURAPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3/c1-20(19(23)22-13-15-8-5-11-24-15)12-17-16(9-10-21-18(17)25-20)14-6-3-2-4-7-14/h2-11H,12-13H2,1H3,(H,22,23).
What are the key properties of N-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide?
N-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-methyl-4-phenyl-3H-furo[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 46948065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).