6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine

C25H26N2O — CID 171435884

IUPAC6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine
SMILESCc1ccc2c(n1)oc1cc(C)c(-c3cc(C)c(CC4CCCC4)cn3)cc12
InChIInChI=1S/C25H26N2O/c1-15-10-23(26-14-19(15)12-18-6-4-5-7-18)21-13-22-20-9-8-17(3)27-25(20)28-24(22)11-16(21)2/h8-11,13-14,18H,4-7,12H2,1-3H3
InChIKeyDGXYAUCGTXWWFS-UHFFFAOYSA-N
MW370.50 g/mol
LogP6.70
Rot. Bonds3

About 6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine

6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine (PubChem CID 171435884) has the molecular formula C25H26N2O and a molecular weight of 370.50 g/mol. Its IUPAC name is 6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine.

Molecular Properties

Compound Name6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine
PubChem CID171435884
Molecular FormulaC25H26N2O
Molecular Weight370.50 g/mol
Exact Mass370.20
IUPAC Name6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine
SMILESCc1ccc2c(n1)oc1cc(C)c(-c3cc(C)c(CC4CCCC4)cn3)cc12
InChIInChI=1S/C25H26N2O/c1-15-10-23(26-14-19(15)12-18-6-4-5-7-18)21-13-22-20-9-8-17(3)27-25(20)28-24(22)11-16(21)2/h8-11,13-14,18H,4-7,12H2,1-3H3
InChIKeyDGXYAUCGTXWWFS-UHFFFAOYSA-N
XLogP6.70
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.50
LogP ≤ 56.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine with MolForge

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Related Compounds

8-[4-(cyclopentylmethyl)-2-pyridinyl]-2,5-dimethyl-[1]benzofuro[2,3-b]pyridine
CID 155612523
8-[4-(cyclopentylmethyl)-2-pyridinyl]-2-methyl-5-phenyl-[1]benzofuro[2,3-b]pyridine
CID 155611470
6-[4-(cyclohexylmethyl)-2-pyridinyl]-2-methyl-7H-[1]benzofuro[2,3-b]pyridin-7-ide;iridium;trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]silane
CID 155612679
2,7-dimethyl-[1]benzofuro[2,3-b]pyridine
CID 122520461
8-[4-(1,1-dideuterioethyl)-5-(trideuteriomethyl)-2-pyridinyl]-2-methyl-[1]benzofuro[2,3-b]pyridine
CID 157270726
2-cyclopentyl-8-(4,5-dimethyl-2-pyridinyl)-[1]benzofuro[2,3-b]pyridine
CID 140791331
5-(cyclopentylmethyl)-2-[7-(2,6-dimethylphenyl)-1H-dibenzofuran-1-id-2-yl]-4-methylpyridine;[4-(cyclopentylmethyl)-6-(3H-naphthalen-3-id-2-yl)-3-pyridinyl]-trimethylgermane;iridium
CID 155611510
1,4-bis(cyclohexylmethyl)-2,5-dimethylbenzene
CID 59821631
8-[5-[2-[3,5-bis[2-(6-phenyl-3-pyridinyl)ethyl]cyclohexyl]ethyl]-4-(trideuteriomethyl)-2-pyridinyl]-2-methyl-[1]benzofuro[2,3-b]pyridine
CID 158586351
[4-(cyclohexylmethyl)-6-[4-(2,6-dimethyl-4-pyridinyl)phenyl]-3-pyridinyl]-trimethylsilane
CID 166576367
[6-[4-tert-butyl-2-(trideuteriomethyl)phenyl]-4-(cyclopentylmethyl)-3-pyridinyl]-trimethylsilane
CID 154591896
dimethyl-[6-(2-methyl-[1]benzofuro[2,3-b]pyridin-6-yl)-3-pyridinyl]-phenylsilane
CID 140720059

Frequently Asked Questions

What is the IUPAC name of 6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine?
The IUPAC name of 6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine (CID 171435884) is 6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine.
What is the SMILES notation for 6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine?
The canonical SMILES for 6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine is Cc1ccc2c(n1)oc1cc(C)c(-c3cc(C)c(CC4CCCC4)cn3)cc12.
What is the InChIKey of 6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine?
The InChIKey is DGXYAUCGTXWWFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O/c1-15-10-23(26-14-19(15)12-18-6-4-5-7-18)21-13-22-20-9-8-17(3)27-25(20)28-24(22)11-16(21)2/h8-11,13-14,18H,4-7,12H2,1-3H3.
What are the key properties of 6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine?
6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine has a molecular weight of 370.50 g/mol, XLogP of 6.70, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-(cyclopentylmethyl)-4-methyl-2-pyridinyl]-2,7-dimethyl-[1]benzofuro[2,3-b]pyridine is sourced from PubChem (CID 171435884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).