5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine

C20H23NO — CID 153463313

IUPAC5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine
SMILESCCC(C)(CC)c1cc(C)cc(-c2cc3ccoc3cn2)c1
InChIInChI=1S/C20H23NO/c1-5-20(4,6-2)17-10-14(3)9-16(11-17)18-12-15-7-8-22-19(15)13-21-18/h7-13H,5-6H2,1-4H3
InChIKeyBPFDPMVVMVIDFH-UHFFFAOYSA-N
MW293.41 g/mol
LogP5.88
Rot. Bonds4

About 5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine

5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine (PubChem CID 153463313) has the molecular formula C20H23NO and a molecular weight of 293.41 g/mol. Its IUPAC name is 5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine.

Molecular Properties

Compound Name5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine
PubChem CID153463313
Molecular FormulaC20H23NO
Molecular Weight293.41 g/mol
Exact Mass293.18
IUPAC Name5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine
SMILESCCC(C)(CC)c1cc(C)cc(-c2cc3ccoc3cn2)c1
InChIInChI=1S/C20H23NO/c1-5-20(4,6-2)17-10-14(3)9-16(11-17)18-12-15-7-8-22-19(15)13-21-18/h7-13H,5-6H2,1-4H3
InChIKeyBPFDPMVVMVIDFH-UHFFFAOYSA-N
XLogP5.88
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.41
LogP ≤ 55.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-methyl-5-(3-methylpentan-3-yl)phenyl]-1,6-naphthyridine
CID 153463443
6-(3-methyl-5-propan-2-ylphenyl)furo[3,2-c]pyridine
CID 153463523
5-(3-tert-butyl-5-methylphenyl)-2-(4-methylphenyl)thieno[2,3-c]pyridine
CID 155626713
6-(3-tert-butyl-5-methylphenyl)-2-phenylthieno[3,2-c]pyridine
CID 155626337
4-fluoro-2-[3-methyl-5-(trifluoromethyl)phenyl]pyridine
CID 130334912
6-(3-tert-butyl-5-methylphenyl)-2-(3,5-dimethylphenyl)thieno[3,2-c]pyridine
CID 155626487
3-(3,5-dimethylphenyl)-6-ethylisoquinoline
CID 170527343
5-bromo-4-methyl-2-[3-(2-methylbutan-2-yl)phenyl]pyridine
CID 139352142
ethane;5-methyl-1-benzofuran;propane
CID 145107108
6-tert-butyl-5-methyl-1-benzofuran
CID 155403484
4-[3,5-bis(trifluoromethyl)phenyl]-2-methylpyrimidine
CID 143532720
5-(3-butan-2-yl-5-methylphenyl)furo[3,2-b]pyridine
CID 153463361

Frequently Asked Questions

What is the IUPAC name of 5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine?
The IUPAC name of 5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine (CID 153463313) is 5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine.
What is the SMILES notation for 5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine?
The canonical SMILES for 5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine is CCC(C)(CC)c1cc(C)cc(-c2cc3ccoc3cn2)c1.
What is the InChIKey of 5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine?
The InChIKey is BPFDPMVVMVIDFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO/c1-5-20(4,6-2)17-10-14(3)9-16(11-17)18-12-15-7-8-22-19(15)13-21-18/h7-13H,5-6H2,1-4H3.
What are the key properties of 5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine?
5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine has a molecular weight of 293.41 g/mol, XLogP of 5.88, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-methyl-5-(3-methylpentan-3-yl)phenyl]furo[2,3-c]pyridine is sourced from PubChem (CID 153463313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).