3-(4-butan-2-ylphenoxy)pyridine

C15H17NO — CID 143794326

IUPAC3-(4-butan-2-ylphenoxy)pyridine
SMILESCCC(C)c1ccc(Oc2cccnc2)cc1
InChIInChI=1S/C15H17NO/c1-3-12(2)13-6-8-14(9-7-13)17-15-5-4-10-16-11-15/h4-12H,3H2,1-2H3
InChIKeyPPYGBXWRDVBPOK-UHFFFAOYSA-N
MW227.31 g/mol
LogP4.39
Rot. Bonds4

About 3-(4-butan-2-ylphenoxy)pyridine

3-(4-butan-2-ylphenoxy)pyridine (PubChem CID 143794326) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is 3-(4-butan-2-ylphenoxy)pyridine.

Molecular Properties

Compound Name3-(4-butan-2-ylphenoxy)pyridine
PubChem CID143794326
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name3-(4-butan-2-ylphenoxy)pyridine
SMILESCCC(C)c1ccc(Oc2cccnc2)cc1
InChIInChI=1S/C15H17NO/c1-3-12(2)13-6-8-14(9-7-13)17-15-5-4-10-16-11-15/h4-12H,3H2,1-2H3
InChIKeyPPYGBXWRDVBPOK-UHFFFAOYSA-N
XLogP4.39
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[2-(4-butan-2-ylphenoxy)ethyl]pyridine
CID 107669015
1-butan-2-yl-4-(3-chlorophenoxy)benzene
CID 90872043
1-[5-(4-butan-2-ylphenoxy)-3-pyridinyl]-N-methylmethanamine
CID 107666689
1-[3-(4-butan-2-ylphenoxy)phenyl]ethanamine
CID 107665344
3-(4-butan-2-ylphenoxy)pyridine-4-carboxylic acid
CID 104629426
[4-(4-butan-2-ylphenoxy)phenyl]methanamine
CID 107663619
3-(4-butan-2-ylphenoxy)pyridine-4-carbothioamide
CID 107664883
N-[(4-butan-2-ylphenyl)-pyridin-3-ylmethyl]ethanamine
CID 43490300
4-[4-(4-butan-2-ylphenoxy)phenyl]phenol
CID 131968930
3-(4-butan-2-ylphenoxy)benzaldehyde
CID 107665630
1-[4-(4-butan-2-ylphenoxy)phenyl]propan-2-amine
CID 107668862
4-(4-butan-2-ylphenoxy)pyridine-2-carbonitrile
CID 107664726

Frequently Asked Questions

What is the IUPAC name of 3-(4-butan-2-ylphenoxy)pyridine?
The IUPAC name of 3-(4-butan-2-ylphenoxy)pyridine (CID 143794326) is 3-(4-butan-2-ylphenoxy)pyridine.
What is the SMILES notation for 3-(4-butan-2-ylphenoxy)pyridine?
The canonical SMILES for 3-(4-butan-2-ylphenoxy)pyridine is CCC(C)c1ccc(Oc2cccnc2)cc1.
What is the InChIKey of 3-(4-butan-2-ylphenoxy)pyridine?
The InChIKey is PPYGBXWRDVBPOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-3-12(2)13-6-8-14(9-7-13)17-15-5-4-10-16-11-15/h4-12H,3H2,1-2H3.
What are the key properties of 3-(4-butan-2-ylphenoxy)pyridine?
3-(4-butan-2-ylphenoxy)pyridine has a molecular weight of 227.31 g/mol, XLogP of 4.39, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-butan-2-ylphenoxy)pyridine is sourced from PubChem (CID 143794326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).