3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine

C20H30N2 — CID 154695378

IUPAC3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine
SMILESCCCc1ccnc(C)c1.Cc1cncc(C)c1CC(C)C
InChIInChI=1S/C11H17N.C9H13N/c1-8(2)5-11-9(3)6-12-7-10(11)4;1-3-4-9-5-6-10-8(2)7-9/h6-8H,5H2,1-4H3;5-7H,3-4H2,1-2H3
InChIKeyMNAARBYDLGHMLX-UHFFFAOYSA-N
MW298.47 g/mol
LogP5.24
Rot. Bonds4

About 3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine

3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine (PubChem CID 154695378) has the molecular formula C20H30N2 and a molecular weight of 298.47 g/mol. Its IUPAC name is 3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine.

Molecular Properties

Compound Name3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine
PubChem CID154695378
Molecular FormulaC20H30N2
Molecular Weight298.47 g/mol
Exact Mass298.24
IUPAC Name3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine
SMILESCCCc1ccnc(C)c1.Cc1cncc(C)c1CC(C)C
InChIInChI=1S/C11H17N.C9H13N/c1-8(2)5-11-9(3)6-12-7-10(11)4;1-3-4-9-5-6-10-8(2)7-9/h6-8H,5H2,1-4H3;5-7H,3-4H2,1-2H3
InChIKeyMNAARBYDLGHMLX-UHFFFAOYSA-N
XLogP5.24
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.47
LogP ≤ 55.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Paraquat dichloride
CID 15938
(+-)-Chlorpheniramine
CID 2725
Ethionamide
CID 2761171
Triprolidine
CID 5282443
Brompheniramine
CID 6834
(+-)-Dimethindene
CID 21855
Dexchlorpheniramine
CID 33036
2,2'-Bipyridine
CID 1474
Pheniramine
CID 4761
Prothionamide
CID 666418
Paraquat
CID 15939
Myosmine
CID 442649

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine?
The IUPAC name of 3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine (CID 154695378) is 3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine.
What is the SMILES notation for 3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine?
The canonical SMILES for 3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine is CCCc1ccnc(C)c1.Cc1cncc(C)c1CC(C)C.
What is the InChIKey of 3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine?
The InChIKey is MNAARBYDLGHMLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N.C9H13N/c1-8(2)5-11-9(3)6-12-7-10(11)4;1-3-4-9-5-6-10-8(2)7-9/h6-8H,5H2,1-4H3;5-7H,3-4H2,1-2H3.
What are the key properties of 3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine?
3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine has a molecular weight of 298.47 g/mol, XLogP of 5.24, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-4-(2-methylpropyl)pyridine;2-methyl-4-propylpyridine is sourced from PubChem (CID 154695378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).