2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine

C82H122Cl6N8S2 — CID 160948945

IUPAC2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine
SMILESCC(C)(C)Cc1ccc(Cl)nc1Cl.CC(C)(C)Cc1ccncc1.CC(C)(C)Cc1cnc(Cl)c(Cl)c1.Cc1cc(Cl)ncc1CC(C)(C)C.Cc1nc(C)c(CC(C)(C)C)s1.Cc1nc(Cl)ccc1CC(C)(C)C.Cc1ncccc1CC(C)(C)C.Cc1ncsc1CC(C)(C)C
InChIInChI=1S/2C11H16ClN.C11H17N.2C10H13Cl2N.C10H17NS.C10H15N.C9H15NS/c1-8-5-10(12)13-7-9(8)6-11(2,3)4;1-8-9(7-11(2,3)4)5-6-10(12)13-8;1-9-10(6-5-7-12-9)8-11(2,3)4;1-10(2,3)5-7-4-8(11)9(12)13-6-7;1-10(2,3)6-7-4-5-8(11)13-9(7)12;1-7-9(6-10(3,4)5)12-8(2)11-7;1-10(2,3)8-9-4-6-11-7-5-9;1-7-8(11-6-10-7)5-9(2,3)4/h5,7H,6H2,1-4H3;5-6H,7H2,1-4H3;5-7H,8H2,1-4H3;4,6H,5H2,1-3H3;4-5H,6H2,1-3H3;6H2,1-5H3;4-7H,8H2,1-3H3;6H,5H2,1-4H3
InChIKeySVMOZOMXKBHGBA-UHFFFAOYSA-N
MW1496.79 g/mol
LogP27.26
Rot. Bonds8

About 2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine

2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine (PubChem CID 160948945) has the molecular formula C82H122Cl6N8S2 and a molecular weight of 1496.79 g/mol. Its IUPAC name is 2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine.

Molecular Properties

Compound Name2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine
PubChem CID160948945
Molecular FormulaC82H122Cl6N8S2
Molecular Weight1496.79 g/mol
Exact Mass1492.74
IUPAC Name2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine
SMILESCC(C)(C)Cc1ccc(Cl)nc1Cl.CC(C)(C)Cc1ccncc1.CC(C)(C)Cc1cnc(Cl)c(Cl)c1.Cc1cc(Cl)ncc1CC(C)(C)C.Cc1nc(C)c(CC(C)(C)C)s1.Cc1nc(Cl)ccc1CC(C)(C)C.Cc1ncccc1CC(C)(C)C.Cc1ncsc1CC(C)(C)C
InChIInChI=1S/2C11H16ClN.C11H17N.2C10H13Cl2N.C10H17NS.C10H15N.C9H15NS/c1-8-5-10(12)13-7-9(8)6-11(2,3)4;1-8-9(7-11(2,3)4)5-6-10(12)13-8;1-9-10(6-5-7-12-9)8-11(2,3)4;1-10(2,3)5-7-4-8(11)9(12)13-6-7;1-10(2,3)6-7-4-5-8(11)13-9(7)12;1-7-9(6-10(3,4)5)12-8(2)11-7;1-10(2,3)8-9-4-6-11-7-5-9;1-7-8(11-6-10-7)5-9(2,3)4/h5,7H,6H2,1-4H3;5-6H,7H2,1-4H3;5-7H,8H2,1-4H3;4,6H,5H2,1-3H3;4-5H,6H2,1-3H3;6H2,1-5H3;4-7H,8H2,1-3H3;6H,5H2,1-4H3
InChIKeySVMOZOMXKBHGBA-UHFFFAOYSA-N
XLogP27.26
TPSA103.12 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms98
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001496.79
LogP ≤ 527.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine?
The IUPAC name of 2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine (CID 160948945) is 2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine.
What is the SMILES notation for 2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine?
The canonical SMILES for 2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine is CC(C)(C)Cc1ccc(Cl)nc1Cl.CC(C)(C)Cc1ccncc1.CC(C)(C)Cc1cnc(Cl)c(Cl)c1.Cc1cc(Cl)ncc1CC(C)(C)C.Cc1nc(C)c(CC(C)(C)C)s1.Cc1nc(Cl)ccc1CC(C)(C)C.Cc1ncccc1CC(C)(C)C.Cc1ncsc1CC(C)(C)C.
What is the InChIKey of 2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine?
The InChIKey is SVMOZOMXKBHGBA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H16ClN.C11H17N.2C10H13Cl2N.C10H17NS.C10H15N.C9H15NS/c1-8-5-10(12)13-7-9(8)6-11(2,3)4;1-8-9(7-11(2,3)4)5-6-10(12)13-8;1-9-10(6-5-7-12-9)8-11(2,3)4;1-10(2,3)5-7-4-8(11)9(12)13-6-7;1-10(2,3)6-7-4-5-8(11)13-9(7)12;1-7-9(6-10(3,4)5)12-8(2)11-7;1-10(2,3)8-9-4-6-11-7-5-9;1-7-8(11-6-10-7)5-9(2,3)4/h5,7H,6H2,1-4H3;5-6H,7H2,1-4H3;5-7H,8H2,1-4H3;4,6H,5H2,1-3H3;4-5H,6H2,1-3H3;6H2,1-5H3;4-7H,8H2,1-3H3;6H,5H2,1-4H3.
What are the key properties of 2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine?
2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine has a molecular weight of 1496.79 g/mol, XLogP of 27.26, 8 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(2,2-dimethylpropyl)-4-methylpyridine;6-chloro-3-(2,2-dimethylpropyl)-2-methylpyridine;2,3-dichloro-5-(2,2-dimethylpropyl)pyridine;2,6-dichloro-3-(2,2-dimethylpropyl)pyridine;5-(2,2-dimethylpropyl)-2,4-dimethyl-1,3-thiazole;3-(2,2-dimethylpropyl)-2-methylpyridine;5-(2,2-dimethylpropyl)-4-methyl-1,3-thiazole;4-(2,2-dimethylpropyl)pyridine is sourced from PubChem (CID 160948945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).