5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine

C20H28N2O2 — CID 69024589

IUPAC5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine
SMILESCCC(C)(C)Oc1ccc(-c2ccc(OC(C)(C)CC)cn2)nc1
InChIInChI=1S/C20H28N2O2/c1-7-19(3,4)23-15-9-11-17(21-13-15)18-12-10-16(14-22-18)24-20(5,6)8-2/h9-14H,7-8H2,1-6H3
InChIKeyZMQGXGLYANSQQP-UHFFFAOYSA-N
MW328.46 g/mol
LogP5.28
Rot. Bonds7

About 5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine

5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine (PubChem CID 69024589) has the molecular formula C20H28N2O2 and a molecular weight of 328.46 g/mol. Its IUPAC name is 5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine.

Molecular Properties

Compound Name5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine
PubChem CID69024589
Molecular FormulaC20H28N2O2
Molecular Weight328.46 g/mol
Exact Mass328.22
IUPAC Name5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine
SMILESCCC(C)(C)Oc1ccc(-c2ccc(OC(C)(C)CC)cn2)nc1
InChIInChI=1S/C20H28N2O2/c1-7-19(3,4)23-15-9-11-17(21-13-15)18-12-10-16(14-22-18)24-20(5,6)8-2/h9-14H,7-8H2,1-6H3
InChIKeyZMQGXGLYANSQQP-UHFFFAOYSA-N
XLogP5.28
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.46
LogP ≤ 55.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-methylbutan-2-yloxy)pyridine-2-carboxylic acid
CID 115491098
1-(2-methylbutan-2-yloxy)-4-[(2-methylpropan-2-yl)oxy]benzene
CID 167138182
1-methyl-4-(2-methylbutan-2-yloxy)benzene
CID 572689
1-(2-methylbutan-2-yloxy)-4-propan-2-ylbenzene
CID 118631923
ethane;1-fluoro-4-(2-methylbutan-2-yloxy)benzene
CID 144811052
1-methyl-4-[4-(2-methylbutan-2-yloxy)phenoxy]benzene
CID 145340247
2-(2-methylbutan-2-yl)-5-(trifluoromethoxy)pyridine
CID 146439449
1-(2-methylbutan-2-yloxy)-4-prop-1-en-2-ylbenzene
CID 22336719
1-butan-2-yloxy-2-methyl-4-(2-methylbutan-2-yloxy)benzene
CID 71021796
1-[(Z)-2,2-dimethylhex-4-en-3-yl]-4-(2-methylbutan-2-yloxy)benzene
CID 173467970
2-(5-methoxy-2-pyridinyl)butan-2-amine
CID 130545492
2-methyl-4-(2-methylbutan-2-yloxy)aniline
CID 43436413

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine?
The IUPAC name of 5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine (CID 69024589) is 5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine.
What is the SMILES notation for 5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine?
The canonical SMILES for 5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine is CCC(C)(C)Oc1ccc(-c2ccc(OC(C)(C)CC)cn2)nc1.
What is the InChIKey of 5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine?
The InChIKey is ZMQGXGLYANSQQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O2/c1-7-19(3,4)23-15-9-11-17(21-13-15)18-12-10-16(14-22-18)24-20(5,6)8-2/h9-14H,7-8H2,1-6H3.
What are the key properties of 5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine?
5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine has a molecular weight of 328.46 g/mol, XLogP of 5.28, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylbutan-2-yloxy)-2-[5-(2-methylbutan-2-yloxy)-2-pyridinyl]pyridine is sourced from PubChem (CID 69024589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).