4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine

C19H25N — CID 129189337

IUPAC4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine
SMILESCc1ccncc1-c1cc(C(C)C)c(C)c(C(C)C)c1
InChIInChI=1S/C19H25N/c1-12(2)17-9-16(10-18(13(3)4)15(17)6)19-11-20-8-7-14(19)5/h7-13H,1-6H3
InChIKeyKGYXLHSJOQDZTO-UHFFFAOYSA-N
MW267.42 g/mol
LogP5.61
Rot. Bonds3

About 4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine

4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine (PubChem CID 129189337) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is 4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine.

Molecular Properties

Compound Name4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine
PubChem CID129189337
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC Name4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine
SMILESCc1ccncc1-c1cc(C(C)C)c(C)c(C(C)C)c1
InChIInChI=1S/C19H25N/c1-12(2)17-9-16(10-18(13(3)4)15(17)6)19-11-20-8-7-14(19)5/h7-13H,1-6H3
InChIKeyKGYXLHSJOQDZTO-UHFFFAOYSA-N
XLogP5.61
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500267.42
LogP ≤ 55.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine?
The IUPAC name of 4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine (CID 129189337) is 4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine.
What is the SMILES notation for 4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine?
The canonical SMILES for 4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine is Cc1ccncc1-c1cc(C(C)C)c(C)c(C(C)C)c1.
What is the InChIKey of 4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine?
The InChIKey is KGYXLHSJOQDZTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-12(2)17-9-16(10-18(13(3)4)15(17)6)19-11-20-8-7-14(19)5/h7-13H,1-6H3.
What are the key properties of 4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine?
4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine has a molecular weight of 267.42 g/mol, XLogP of 5.61, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-[4-methyl-3,5-di(propan-2-yl)phenyl]pyridine is sourced from PubChem (CID 129189337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).