4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide

C20H15FN2O3 — CID 86764448

IUPAC4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide
SMILESCOc1cccc(CNC(=O)c2ccc3c(c2)oc2cncc(F)c23)c1
InChIInChI=1S/C20H15FN2O3/c1-25-14-4-2-3-12(7-14)9-23-20(24)13-5-6-15-17(8-13)26-18-11-22-10-16(21)19(15)18/h2-8,10-11H,9H2,1H3,(H,23,24)
InChIKeyBZNCLGNOCBYFCP-UHFFFAOYSA-N
MW350.35 g/mol
LogP4.06
Rot. Bonds4

About 4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide

4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide (PubChem CID 86764448) has the molecular formula C20H15FN2O3 and a molecular weight of 350.35 g/mol. Its IUPAC name is 4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide.

Molecular Properties

Compound Name4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide
PubChem CID86764448
Molecular FormulaC20H15FN2O3
Molecular Weight350.35 g/mol
Exact Mass350.11
IUPAC Name4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide
SMILESCOc1cccc(CNC(=O)c2ccc3c(c2)oc2cncc(F)c23)c1
InChIInChI=1S/C20H15FN2O3/c1-25-14-4-2-3-12(7-14)9-23-20(24)13-5-6-15-17(8-13)26-18-11-22-10-16(21)19(15)18/h2-8,10-11H,9H2,1H3,(H,23,24)
InChIKeyBZNCLGNOCBYFCP-UHFFFAOYSA-N
XLogP4.06
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.35
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-fluorobenzyl)-N-[2-(2-pyridinyl)ethyl]-1,3-benzoxazole-6-carboxamide
CID 24816611
3,5,6-trimethyl-N-(pyridin-4-ylmethyl)-1-benzofuran-2-carboxamide
CID 975422
6-Hydroxy-3-methoxy-4-phenylbenzo[4,3-b]pyridine
CID 406462
1-Aza-9-oxafluorene deriv. 7c
CID 6538869
4-Phenyl-[1]benzofuro[2,3-b]pyridine-3,6-diol
CID 51000510
6-Methoxy-4-phenyl-3-phenylmethoxy-[1]benzofuro[2,3-b]pyridine
CID 71455067
N-[[5-fluoro-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]dibenzofuran-3-carboxamide
CID 134142008
N-[[4-(2-methyl-4-pyridinyl)phenyl]methyl]dibenzofuran-3-carboxamide
CID 134150726
4-[5-(2-Fluoro-4-aminocarbonyl-phenyl)-furo[2,3-c]pyridin-2-yl]-piperidine-1-carboxylic acid tert-butyl ester
CID 71736417
(R)-4-fluoro-N-(1-(3-methoxyphenyl) ethyl)benzofuro [2,3-c] pyridine-7-carboxamide
CID 86764449
N-((2,2-difluorobenzo [d][1,3]dioxo1-5-y1)methyl) benzofuro[2,3-c]pyridine-7-carboxamide
CID 86764450
N-(2-fluorobenzyl) benzofuro[2,3-c] pyridine-7-carboxamide
CID 86764558

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide?
The IUPAC name of 4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide (CID 86764448) is 4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide.
What is the SMILES notation for 4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide?
The canonical SMILES for 4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide is COc1cccc(CNC(=O)c2ccc3c(c2)oc2cncc(F)c23)c1.
What is the InChIKey of 4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide?
The InChIKey is BZNCLGNOCBYFCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN2O3/c1-25-14-4-2-3-12(7-14)9-23-20(24)13-5-6-15-17(8-13)26-18-11-22-10-16(21)19(15)18/h2-8,10-11H,9H2,1H3,(H,23,24).
What are the key properties of 4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide?
4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide has a molecular weight of 350.35 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[(3-methoxyphenyl)methyl]-[1]benzofuro[2,3-c]pyridine-7-carboxamide is sourced from PubChem (CID 86764448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).