2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine

C22H26N2 — CID 177029893

IUPAC2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine
SMILESCC(C)c1ccc(-c2ccccc2)nc1.CC(C)c1cccnc1
InChIInChI=1S/C14H15N.C8H11N/c1-11(2)13-8-9-14(15-10-13)12-6-4-3-5-7-12;1-7(2)8-4-3-5-9-6-8/h3-11H,1-2H3;3-7H,1-2H3
InChIKeyZHMAPTMBUKMDEH-UHFFFAOYSA-N
MW318.46 g/mol
LogP6.08
Rot. Bonds3

About 2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine

2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine (PubChem CID 177029893) has the molecular formula C22H26N2 and a molecular weight of 318.46 g/mol. Its IUPAC name is 2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine.

Molecular Properties

Compound Name2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine
PubChem CID177029893
Molecular FormulaC22H26N2
Molecular Weight318.46 g/mol
Exact Mass318.21
IUPAC Name2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine
SMILESCC(C)c1ccc(-c2ccccc2)nc1.CC(C)c1cccnc1
InChIInChI=1S/C14H15N.C8H11N/c1-11(2)13-8-9-14(15-10-13)12-6-4-3-5-7-12;1-7(2)8-4-3-5-9-6-8/h3-11H,1-2H3;3-7H,1-2H3
InChIKeyZHMAPTMBUKMDEH-UHFFFAOYSA-N
XLogP6.08
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.46
LogP ≤ 56.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;methane;3-propan-2-ylpyridine;sulfane
CID 159647027
2-phenyl-4-(4-phenylphenyl)-6-[4-[4-(5-pyridin-3-yl-2-pyridinyl)phenyl]phenyl]-1,3,5-triazine
CID 134380728
bis(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine)
CID 158875666
cumene;ethane;2-propan-2-ylpyridine;3-propan-2-ylpyridine
CID 159528038
methane;3-propan-2-ylpyridine;4-propan-2-ylpyridine
CID 177028413
3-[(1R)-1-phenylethyl]pyridine
CID 13287121
ethane;methane;2-propan-2-ylpyrazine;3-propan-2-ylpyridine
CID 161329033
cumene;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylthiophene
CID 158523249
2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine
CID 155572043
2-(3-phenyl-5-propan-2-ylphenyl)pyridine;3-(3-phenyl-5-propan-2-ylphenyl)pyridine;2-(3-propan-2-yl-5-pyridin-2-ylphenyl)pyridine;2-(3-propan-2-yl-5-pyridin-3-ylphenyl)pyridine;2-(3-propan-2-yl-5-pyridin-4-ylphenyl)pyridine;3-(3-propan-2-yl-5-pyridin-3-ylphenyl)pyridine;3-(3-propan-2-yl-5-pyridin-4-ylphenyl)pyridine
CID 158633423
methane;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine
CID 158880002
3-phenyl-6-pyridin-3-ylpyridazine
CID 12712239

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine?
The IUPAC name of 2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine (CID 177029893) is 2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine.
What is the SMILES notation for 2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine?
The canonical SMILES for 2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine is CC(C)c1ccc(-c2ccccc2)nc1.CC(C)c1cccnc1.
What is the InChIKey of 2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine?
The InChIKey is ZHMAPTMBUKMDEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N.C8H11N/c1-11(2)13-8-9-14(15-10-13)12-6-4-3-5-7-12;1-7(2)8-4-3-5-9-6-8/h3-11H,1-2H3;3-7H,1-2H3.
What are the key properties of 2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine?
2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine has a molecular weight of 318.46 g/mol, XLogP of 6.08, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine is sourced from PubChem (CID 177029893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).