2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine

C24H38N2 — CID 160753503

IUPAC2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine
SMILESCCCc1c(C)c(C)nc(C)c1C.CCCc1nc(C)c(C)c(C)c1C
InChIInChI=1S/2C12H19N/c1-6-7-12-8(2)10(4)13-11(5)9(12)3;1-6-7-12-10(4)8(2)9(3)11(5)13-12/h2*6-7H2,1-5H3
InChIKeyRXCZIMLWFDPIPN-UHFFFAOYSA-N
MW354.58 g/mol
LogP6.54
Rot. Bonds4

About 2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine

2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine (PubChem CID 160753503) has the molecular formula C24H38N2 and a molecular weight of 354.58 g/mol. Its IUPAC name is 2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine.

Molecular Properties

Compound Name2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine
PubChem CID160753503
Molecular FormulaC24H38N2
Molecular Weight354.58 g/mol
Exact Mass354.30
IUPAC Name2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine
SMILESCCCc1c(C)c(C)nc(C)c1C.CCCc1nc(C)c(C)c(C)c1C
InChIInChI=1S/2C12H19N/c1-6-7-12-8(2)10(4)13-11(5)9(12)3;1-6-7-12-10(4)8(2)9(3)11(5)13-12/h2*6-7H2,1-5H3
InChIKeyRXCZIMLWFDPIPN-UHFFFAOYSA-N
XLogP6.54
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 ≤ 56.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-diethyl-3,5,6-trimethylpyridine
CID 59964349
5-(hydroxymethyl)-2,4-dimethyl-6-propylpyridin-3-ol
CID 58636723
1-methyl-3,4-dipropylisoquinoline
CID 44606949
1,3,5,6-tetramethyl-4-propylpyrazolo[3,4-b]pyridine
CID 142348062
5-methyl-2,4-di(propan-2-yl)-6-propylpyrimidine
CID 140752130
tris(2,3,4,5,6-pentamethylpyridine);tris(2,4,5,6-tetramethylpyrimidine)
CID 157180275
2-ethyl-4,5,6-trimethylpyridin-3-ol
CID 20644950
3-ethyl-1-methyl-4-propylisoquinoline
CID 153439364
4-methyl-5-propyl-2H-triazole
CID 23402789
tris(2,3,4,5,6-pentamethylpyridine);2,3,5,6-tetramethylpyrazine;tris(2,4,5,6-tetramethylpyrimidine)
CID 159315646
[5-(hydroxymethyl)-2,4-dimethyl-6-propyl-3-pyridinyl] acetate
CID 58636831
4-butyl-5,6-dimethyl-2-phenylpyrimidine
CID 138967628

Frequently Asked Questions

What is the IUPAC name of 2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine?
The IUPAC name of 2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine (CID 160753503) is 2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine.
What is the SMILES notation for 2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine?
The canonical SMILES for 2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine is CCCc1c(C)c(C)nc(C)c1C.CCCc1nc(C)c(C)c(C)c1C.
What is the InChIKey of 2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine?
The InChIKey is RXCZIMLWFDPIPN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H19N/c1-6-7-12-8(2)10(4)13-11(5)9(12)3;1-6-7-12-10(4)8(2)9(3)11(5)13-12/h2*6-7H2,1-5H3.
What are the key properties of 2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine?
2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine has a molecular weight of 354.58 g/mol, XLogP of 6.54, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetramethyl-6-propylpyridine;2,3,5,6-tetramethyl-4-propylpyridine is sourced from PubChem (CID 160753503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).