2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide

C21H18FN3O3 — CID 134806312

IUPAC2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide
SMILESCOc1ccc(-c2cnc(NC(=O)Cc3ccc(F)cc3)c3c2CCO3)cn1
InChIInChI=1S/C21H18FN3O3/c1-27-19-7-4-14(11-23-19)17-12-24-21(20-16(17)8-9-28-20)25-18(26)10-13-2-5-15(22)6-3-13/h2-7,11-12H,8-10H2,1H3,(H,24,25,26)
InChIKeyWWWJBDWHNQOBRD-UHFFFAOYSA-N
MW379.39 g/mol
LogP3.41
Rot. Bonds5

About 2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide

2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide (PubChem CID 134806312) has the molecular formula C21H18FN3O3 and a molecular weight of 379.39 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide
PubChem CID134806312
Molecular FormulaC21H18FN3O3
Molecular Weight379.39 g/mol
Exact Mass379.13
IUPAC Name2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide
SMILESCOc1ccc(-c2cnc(NC(=O)Cc3ccc(F)cc3)c3c2CCO3)cn1
InChIInChI=1S/C21H18FN3O3/c1-27-19-7-4-14(11-23-19)17-12-24-21(20-16(17)8-9-28-20)25-18(26)10-13-2-5-15(22)6-3-13/h2-7,11-12H,8-10H2,1H3,(H,24,25,26)
InChIKeyWWWJBDWHNQOBRD-UHFFFAOYSA-N
XLogP3.41
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.39
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide?
The IUPAC name of 2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide (CID 134806312) is 2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide is COc1ccc(-c2cnc(NC(=O)Cc3ccc(F)cc3)c3c2CCO3)cn1.
What is the InChIKey of 2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide?
The InChIKey is WWWJBDWHNQOBRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18FN3O3/c1-27-19-7-4-14(11-23-19)17-12-24-21(20-16(17)8-9-28-20)25-18(26)10-13-2-5-15(22)6-3-13/h2-7,11-12H,8-10H2,1H3,(H,24,25,26).
What are the key properties of 2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide?
2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide has a molecular weight of 379.39 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-[4-(6-methoxy-3-pyridinyl)-2,3-dihydrofuro[2,3-c]pyridin-7-yl]acetamide is sourced from PubChem (CID 134806312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).