3-methyl-4-(4-propan-2-ylphenoxy)pyridine

C15H17NO — CID 121004835

IUPAC3-methyl-4-(4-propan-2-ylphenoxy)pyridine
SMILESCc1cnccc1Oc1ccc(C(C)C)cc1
InChIInChI=1S/C15H17NO/c1-11(2)13-4-6-14(7-5-13)17-15-8-9-16-10-12(15)3/h4-11H,1-3H3
InChIKeyPEKDNBRDGVOILJ-UHFFFAOYSA-N
MW227.31 g/mol
LogP4.31
Rot. Bonds3

About 3-methyl-4-(4-propan-2-ylphenoxy)pyridine

3-methyl-4-(4-propan-2-ylphenoxy)pyridine (PubChem CID 121004835) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is 3-methyl-4-(4-propan-2-ylphenoxy)pyridine.

Molecular Properties

Compound Name3-methyl-4-(4-propan-2-ylphenoxy)pyridine
PubChem CID121004835
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name3-methyl-4-(4-propan-2-ylphenoxy)pyridine
SMILESCc1cnccc1Oc1ccc(C(C)C)cc1
InChIInChI=1S/C15H17NO/c1-11(2)13-4-6-14(7-5-13)17-15-8-9-16-10-12(15)3/h4-11H,1-3H3
InChIKeyPEKDNBRDGVOILJ-UHFFFAOYSA-N
XLogP4.31
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-3-(4-propan-2-ylphenoxy)aniline
CID 155433623
2-chloro-5-[(3-methyl-4-pyridinyl)oxy]benzoic acid
CID 106502871
2-methyl-4-[(3-methyl-4-pyridinyl)oxy]-5-propan-2-ylaniline
CID 65216967
3-(chloromethyl)-4-(3-propan-2-ylphenoxy)pyridine
CID 81233837
1,4-di(propan-2-yl)benzene;2-methyl-1-(2-methyl-4-propan-2-ylphenyl)-4-propan-2-ylbenzene;1-propan-2-yl-4-(4-propan-2-ylphenoxy)benzene
CID 159090992
2-methyl-3-(4-propan-2-ylphenoxy)phenol
CID 91567072
2,6-dimethyl-3-[(3-methyl-4-pyridinyl)oxy]pyridine
CID 145135552
[6-methyl-4-(4-propan-2-ylphenoxy)-3-pyridinyl]methanol
CID 81238941
N-[(3-methyl-4-pyridinyl)methyl]-1-(4-propan-2-ylphenyl)ethanamine
CID 114699302
4-methyl-3-(4-propan-2-ylphenoxy)benzaldehyde
CID 105405402
3-chloro-4-(4-propan-2-ylphenoxy)aniline
CID 26189720
[4-(3-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 81250345

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-(4-propan-2-ylphenoxy)pyridine?
The IUPAC name of 3-methyl-4-(4-propan-2-ylphenoxy)pyridine (CID 121004835) is 3-methyl-4-(4-propan-2-ylphenoxy)pyridine.
What is the SMILES notation for 3-methyl-4-(4-propan-2-ylphenoxy)pyridine?
The canonical SMILES for 3-methyl-4-(4-propan-2-ylphenoxy)pyridine is Cc1cnccc1Oc1ccc(C(C)C)cc1.
What is the InChIKey of 3-methyl-4-(4-propan-2-ylphenoxy)pyridine?
The InChIKey is PEKDNBRDGVOILJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-11(2)13-4-6-14(7-5-13)17-15-8-9-16-10-12(15)3/h4-11H,1-3H3.
What are the key properties of 3-methyl-4-(4-propan-2-ylphenoxy)pyridine?
3-methyl-4-(4-propan-2-ylphenoxy)pyridine has a molecular weight of 227.31 g/mol, XLogP of 4.31, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(4-propan-2-ylphenoxy)pyridine is sourced from PubChem (CID 121004835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).