4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine

C23H23NO — CID 140607533

IUPAC4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine
SMILESCC(C)c1ccnc(-c2cccc3c2oc2cc(C(C)C)ccc23)c1
InChIInChI=1S/C23H23NO/c1-14(2)16-8-9-18-19-6-5-7-20(23(19)25-22(18)13-16)21-12-17(15(3)4)10-11-24-21/h5-15H,1-4H3
InChIKeyURRAXZIQFLQREX-UHFFFAOYSA-N
MW329.44 g/mol
LogP6.89
Rot. Bonds3

About 4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine

4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine (PubChem CID 140607533) has the molecular formula C23H23NO and a molecular weight of 329.44 g/mol. Its IUPAC name is 4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine.

Molecular Properties

Compound Name4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine
PubChem CID140607533
Molecular FormulaC23H23NO
Molecular Weight329.44 g/mol
Exact Mass329.18
IUPAC Name4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine
SMILESCC(C)c1ccnc(-c2cccc3c2oc2cc(C(C)C)ccc23)c1
InChIInChI=1S/C23H23NO/c1-14(2)16-8-9-18-19-6-5-7-20(23(19)25-22(18)13-16)21-12-17(15(3)4)10-11-24-21/h5-15H,1-4H3
InChIKeyURRAXZIQFLQREX-UHFFFAOYSA-N
XLogP6.89
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.44
LogP ≤ 56.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-dibenzofuran-4-yl-4-propan-2-ylpyridine
CID 71236331
2-[7-(1-deuterio-1-phenylethyl)dibenzofuran-4-yl]-4-(2-deuteriopropan-2-yl)pyridine
CID 162708190
2-(7-tert-butyldibenzofuran-4-yl)-4-(2-deuteriopropan-2-yl)pyridine
CID 165169386
3-phenyl-8-(4-propan-2-yl-2-pyridinyl)-[1]benzofuro[2,3-c]pyridine
CID 155610525
2-dibenzofuran-4-yl-4-(1-phenylethyl)pyridine
CID 162707337
4-(2-deuteriopropan-2-yl)-2-[7-[4-(trideuteriomethyl)phenyl]dibenzofuran-4-yl]pyridine
CID 166573548
trimethyl-[10-(4-propan-2-yl-2-pyridinyl)naphtho[1,2-b][1]benzofuran-3-yl]silane
CID 164832366
4-(3-methylbutan-2-yl)-2-(7-naphthalen-1-yldibenzofuran-4-yl)pyridine
CID 155611887
4-(4-propan-2-yl-2-pyridinyl)-[1]benzofuro[3,2-c]pyridine
CID 90140758
4-[1-deuterio-1-(4-fluorophenyl)ethyl]-2-dibenzofuran-4-ylpyridine
CID 177279356
trimethyl-[4-phenyl-6-(4-propan-2-yl-2-pyridinyl)dibenzofuran-3-yl]germane
CID 164832486
2-[8-phenyl-6-(trideuteriomethyl)dibenzofuran-4-yl]-4-propan-2-ylpyridine
CID 166577199

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine?
The IUPAC name of 4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine (CID 140607533) is 4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine.
What is the SMILES notation for 4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine?
The canonical SMILES for 4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine is CC(C)c1ccnc(-c2cccc3c2oc2cc(C(C)C)ccc23)c1.
What is the InChIKey of 4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine?
The InChIKey is URRAXZIQFLQREX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23NO/c1-14(2)16-8-9-18-19-6-5-7-20(23(19)25-22(18)13-16)21-12-17(15(3)4)10-11-24-21/h5-15H,1-4H3.
What are the key properties of 4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine?
4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine has a molecular weight of 329.44 g/mol, XLogP of 6.89, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-2-(7-propan-2-yldibenzofuran-4-yl)pyridine is sourced from PubChem (CID 140607533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).