7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine

C15H13ClFNO — CID 144796354

IUPAC7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine
SMILESCc1cc2c(c(-c3ccc(F)c(Cl)c3)n1)OCC2C
InChIInChI=1S/C15H13ClFNO/c1-8-7-19-15-11(8)5-9(2)18-14(15)10-3-4-13(17)12(16)6-10/h3-6,8H,7H2,1-2H3
InChIKeyHNTURIZFMHCOLQ-UHFFFAOYSA-N
MW277.73 g/mol
LogP4.35
Rot. Bonds1

About 7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine

7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine (PubChem CID 144796354) has the molecular formula C15H13ClFNO and a molecular weight of 277.73 g/mol. Its IUPAC name is 7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine.

Molecular Properties

Compound Name7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine
PubChem CID144796354
Molecular FormulaC15H13ClFNO
Molecular Weight277.73 g/mol
Exact Mass277.07
IUPAC Name7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine
SMILESCc1cc2c(c(-c3ccc(F)c(Cl)c3)n1)OCC2C
InChIInChI=1S/C15H13ClFNO/c1-8-7-19-15-11(8)5-9(2)18-14(15)10-3-4-13(17)12(16)6-10/h3-6,8H,7H2,1-2H3
InChIKeyHNTURIZFMHCOLQ-UHFFFAOYSA-N
XLogP4.35
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.73
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Fluoro-3-(octyloxy)-6-[4-(octyloxy)phenyl]pyridine
CID 19046959
2-Chloro-3-phenylmethoxy-6-(trifluoromethyl)pyridine
CID 102361414
6-Chloro-2-(4-ethoxyphenyl)-3-(trifluoromethyl)pyridine
CID 102449554
3-Benzyloxy-6-chloromethyl-2-methylpyridine
CID 23321881
4-Chloro-2-[4-(4-fluorophenoxy)phenyl]-6-methylpyridine
CID 11438401
3-Dodecoxy-2-fluoro-6-(4-heptoxyphenyl)pyridine
CID 20092145
2-(2-Chloro-4-methylphenoxy)-6-(2,2-dimethylpropoxymethyl)-3-fluoropyridine
CID 20202478
2-[(4-Tert-butyl-2-chlorophenoxy)methyl]-6-fluoropyridine
CID 58442804
6-[4-[4-[4-[(E)-but-1-enyl]cyclohexen-1-yl]-2-chloro-3-fluorophenyl]phenyl]-3-butoxy-2-fluoropyridine
CID 59256970
2-[(2-Chloro-4-ethylphenoxy)methyl]-6-fluoropyridine
CID 68242281
6-[4-[4-(4-But-1-enylcyclohexen-1-yl)-2-chloro-3-fluorophenyl]phenyl]-3-butoxy-2-fluoropyridine
CID 72263263
6-Chloro-2-(4-chloro-phenyl)-3-(2,2,2-trifluoro-ethoxy)-pyridine
CID 87103607

Frequently Asked Questions

What is the IUPAC name of 7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine?
The IUPAC name of 7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine (CID 144796354) is 7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine.
What is the SMILES notation for 7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine?
The canonical SMILES for 7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine is Cc1cc2c(c(-c3ccc(F)c(Cl)c3)n1)OCC2C.
What is the InChIKey of 7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine?
The InChIKey is HNTURIZFMHCOLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFNO/c1-8-7-19-15-11(8)5-9(2)18-14(15)10-3-4-13(17)12(16)6-10/h3-6,8H,7H2,1-2H3.
What are the key properties of 7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine?
7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine has a molecular weight of 277.73 g/mol, XLogP of 4.35, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-chloro-4-fluorophenyl)-3,5-dimethyl-2,3-dihydrofuro[2,3-c]pyridine is sourced from PubChem (CID 144796354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).