3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine

C24H38N2 — CID 158667485

IUPAC3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine
SMILESCc1cc(C(C)C)cnc1C(C)C.Cc1cc(C(C)C)ncc1C(C)C
InChIInChI=1S/2C12H19N/c1-8(2)11-7-13-12(9(3)4)6-10(11)5;1-8(2)11-6-10(5)12(9(3)4)13-7-11/h2*6-9H,1-5H3
InChIKeyIDNSRMCTSVURKC-UHFFFAOYSA-N
MW354.58 g/mol
LogP7.27
Rot. Bonds4

About 3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine

3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine (PubChem CID 158667485) has the molecular formula C24H38N2 and a molecular weight of 354.58 g/mol. Its IUPAC name is 3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine.

Molecular Properties

Compound Name3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine
PubChem CID158667485
Molecular FormulaC24H38N2
Molecular Weight354.58 g/mol
Exact Mass354.30
IUPAC Name3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine
SMILESCc1cc(C(C)C)cnc1C(C)C.Cc1cc(C(C)C)ncc1C(C)C
InChIInChI=1S/2C12H19N/c1-8(2)11-7-13-12(9(3)4)6-10(11)5;1-8(2)11-6-10(5)12(9(3)4)13-7-11/h2*6-9H,1-5H3
InChIKeyIDNSRMCTSVURKC-UHFFFAOYSA-N
XLogP7.27
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.58
LogP ≤ 57.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;2,4,5-tri(propan-2-yl)pyridine
CID 167652229
5-methyl-6-propan-2-ylpyridin-3-ol
CID 134185781
2-tert-butyl-3-methyl-5-propan-2-ylpyridine
CID 134415008
trimethyl-(5-methyl-6-propan-2-yl-3-pyridinyl)silane
CID 154601779
2-ethoxy-3-methyl-5-propan-2-ylpyridine
CID 130320628
N,N,3-trimethyl-5-propan-2-ylpyridin-2-amine
CID 130320637
3-methyl-5-(1-methylpiperidin-4-yl)-2-propan-2-ylpyridine
CID 170588740
ethane;3-methyl-2-propan-2-ylpyridine;bis(4-methyl-3-propan-2-ylpyridine)
CID 167681934
4-cyclopropyl-5-methyl-2-propan-2-ylpyridine
CID 165379120
2,5-di(propan-2-yl)pyridine;2-fluoro-1,4-di(propan-2-yl)benzene
CID 167631369
imino-methyl-(4-methyl-5-propan-2-yl-2-pyridinyl)-oxo-λ6-sulfane
CID 146966429
2,3,5-tri(propan-2-yl)pyrazine
CID 58164581

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine?
The IUPAC name of 3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine (CID 158667485) is 3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine.
What is the SMILES notation for 3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine?
The canonical SMILES for 3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine is Cc1cc(C(C)C)cnc1C(C)C.Cc1cc(C(C)C)ncc1C(C)C.
What is the InChIKey of 3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine?
The InChIKey is IDNSRMCTSVURKC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H19N/c1-8(2)11-7-13-12(9(3)4)6-10(11)5;1-8(2)11-6-10(5)12(9(3)4)13-7-11/h2*6-9H,1-5H3.
What are the key properties of 3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine?
3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine has a molecular weight of 354.58 g/mol, XLogP of 7.27, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2,5-di(propan-2-yl)pyridine;4-methyl-2,5-di(propan-2-yl)pyridine is sourced from PubChem (CID 158667485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).