4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide

C20H15F2N3O2 — CID 7289201

IUPAC4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide
SMILESO=C(NCc1ccccn1)c1cc2occc2n1Cc1ccc(F)c(F)c1
InChIInChI=1S/C20H15F2N3O2/c21-15-5-4-13(9-16(15)22)12-25-17-6-8-27-19(17)10-18(25)20(26)24-11-14-3-1-2-7-23-14/h1-10H,11-12H2,(H,24,26)
InChIKeyVVAPHUFMTQGLNJ-UHFFFAOYSA-N
MW367.36 g/mol
LogP3.89
Rot. Bonds5

About 4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide

4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide (PubChem CID 7289201) has the molecular formula C20H15F2N3O2 and a molecular weight of 367.36 g/mol. Its IUPAC name is 4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide.

Molecular Properties

Compound Name4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide
PubChem CID7289201
Molecular FormulaC20H15F2N3O2
Molecular Weight367.36 g/mol
Exact Mass367.11
IUPAC Name4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide
SMILESO=C(NCc1ccccn1)c1cc2occc2n1Cc1ccc(F)c(F)c1
InChIInChI=1S/C20H15F2N3O2/c21-15-5-4-13(9-16(15)22)12-25-17-6-8-27-19(17)10-18(25)20(26)24-11-14-3-1-2-7-23-14/h1-10H,11-12H2,(H,24,26)
InChIKeyVVAPHUFMTQGLNJ-UHFFFAOYSA-N
XLogP3.89
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.36
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(3,4-difluorophenyl)methyl]-N-(4-phenylbutan-2-yl)furo[3,2-b]pyrrole-5-carboxamide
CID 42790915
4-[(2-fluorophenyl)methyl]-2-methyl-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide
CID 42791219
3-[1-[(3,4-difluorophenyl)methyl]piperidin-4-yl]-N-(pyridin-2-ylmethyl)-1,2-oxazole-5-carboxamide
CID 92577470
4-[(2,6-difluorophenyl)methyl]-N-(2-phenylethyl)furo[3,2-b]pyrrole-5-carboxamide
CID 42790861
4-[(2-fluorophenyl)methyl]-N-(pyridin-2-ylmethyl)thieno[3,2-b]pyrrole-5-carboxamide
CID 46038876
4-[(2-fluorophenyl)methyl]-N-(1,3-thiazol-2-yl)furo[3,2-b]pyrrole-5-carboxamide
CID 45491439
4-benzyl-N-(3-hydroxypropyl)furo[3,2-b]pyrrole-5-carboxamide
CID 45496120
4-[(3,4-difluorophenyl)methyl]-N-ethyl-2-methylthieno[3,2-b]pyrrole-5-carboxamide
CID 46039675
2-[[4-[(4-tert-butylphenyl)methyl]furo[3,2-b]pyrrole-5-carbonyl]amino]ethyl-dimethylazanium
CID 7417311
1-benzyl-5-(dimethylsulfamoyl)-N-(pyridin-2-ylmethyl)indole-2-carboxamide
CID 50802080
4-[(3,5-dimethoxyphenyl)methyl]-N-propylfuro[3,2-b]pyrrole-5-carboxamide
CID 42792536
4-[(3-chlorophenyl)methyl]-N-(2-piperidin-1-ylethyl)furo[3,2-b]pyrrole-5-carboxamide
CID 3966910

Frequently Asked Questions

What is the IUPAC name of 4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide?
The IUPAC name of 4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide (CID 7289201) is 4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide.
What is the SMILES notation for 4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide?
The canonical SMILES for 4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide is O=C(NCc1ccccn1)c1cc2occc2n1Cc1ccc(F)c(F)c1.
What is the InChIKey of 4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide?
The InChIKey is VVAPHUFMTQGLNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F2N3O2/c21-15-5-4-13(9-16(15)22)12-25-17-6-8-27-19(17)10-18(25)20(26)24-11-14-3-1-2-7-23-14/h1-10H,11-12H2,(H,24,26).
What are the key properties of 4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide?
4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide has a molecular weight of 367.36 g/mol, XLogP of 3.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3,4-difluorophenyl)methyl]-N-(pyridin-2-ylmethyl)furo[3,2-b]pyrrole-5-carboxamide is sourced from PubChem (CID 7289201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).