2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole

C64H72Cl7N13S2 — CID 158353374

IUPAC2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole
SMILESCC1CC1(Cl)Cl.Cc1cc(Cl)ccn1.Cc1ccc(Cl)cn1.Cc1cccc(Cl)n1.Cc1ccccn1.Cc1cccnc1.Cc1ccncc1.Cc1ccncn1.Cc1csc(Cl)n1.Cc1cscn1.Cc1ncccc1Cl.Cc1ncccn1
InChIInChI=1S/4C6H6ClN.3C6H7N.2C5H6N2.C4H6Cl2.C4H4ClNS.C4H5NS/c1-5-4-6(7)2-3-8-5;1-5-2-3-6(7)4-8-5;1-5-6(7)3-2-4-8-5;1-5-3-2-4-6(7)8-5;1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;1-6-4-2-3-5-7-6;1-5-2-3-6-4-7-5;1-5-6-3-2-4-7-5;1-3-2-4(3,5)6;1-3-2-7-4(5)6-3;1-4-2-6-3-5-4/h4*2-4H,1H3;3*2-5H,1H3;2*2-4H,1H3;3H,2H2,1H3;2H,1H3;2-3H,1H3
InChIKeyGSOXKZRYPVSTCK-UHFFFAOYSA-N
MW1335.68 g/mol
LogP19.67
Rot. Bonds

About 2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole

2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole (PubChem CID 158353374) has the molecular formula C64H72Cl7N13S2 and a molecular weight of 1335.68 g/mol. Its IUPAC name is 2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole.

Molecular Properties

Compound Name2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole
PubChem CID158353374
Molecular FormulaC64H72Cl7N13S2
Molecular Weight1335.68 g/mol
Exact Mass1331.33
IUPAC Name2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole
SMILESCC1CC1(Cl)Cl.Cc1cc(Cl)ccn1.Cc1ccc(Cl)cn1.Cc1cccc(Cl)n1.Cc1ccccn1.Cc1cccnc1.Cc1ccncc1.Cc1ccncn1.Cc1csc(Cl)n1.Cc1cscn1.Cc1ncccc1Cl.Cc1ncccn1
InChIInChI=1S/4C6H6ClN.3C6H7N.2C5H6N2.C4H6Cl2.C4H4ClNS.C4H5NS/c1-5-4-6(7)2-3-8-5;1-5-2-3-6(7)4-8-5;1-5-6(7)3-2-4-8-5;1-5-3-2-4-6(7)8-5;1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;1-6-4-2-3-5-7-6;1-5-2-3-6-4-7-5;1-5-6-3-2-4-7-5;1-3-2-4(3,5)6;1-3-2-7-4(5)6-3;1-4-2-6-3-5-4/h4*2-4H,1H3;3*2-5H,1H3;2*2-4H,1H3;3H,2H2,1H3;2H,1H3;2-3H,1H3
InChIKeyGSOXKZRYPVSTCK-UHFFFAOYSA-N
XLogP19.67
TPSA167.57 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds
Heavy Atoms86
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001335.68
LogP ≤ 519.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

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

Analyze 2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole with MolForge

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Launch Full Analysis

Related Compounds

2-chloro-4-iodo-5-methylpyridine;N-[2-chloro-5-(trifluoromethyl)-4-pyridinyl]-5-pyrimidin-2-yl-1,3-thiazol-4-amine;5-pyrimidin-2-yl-1,3-thiazol-4-amine
CID 158818341
2-[(3-chloro-5-ethyl-4-pyridinyl)methylsulfanyl]-4-(1,1-difluoroethyl)-1H-pyrimidin-6-one;2-[(3-chloro-5-ethyl-4-pyridinyl)methylsulfanyl]-4,6-dimethylpyrimidine;2-[(2,4-dichloro-3-pyridinyl)methylsulfanyl]-4-methyl-1H-pyrimidin-6-one;2-[(3,5-diethyl-4-pyridinyl)methylsulfanyl]-4-(1,1-difluoroethyl)-1H-pyrimidin-6-one;2-[(3,5-diethyl-4-pyridinyl)methylsulfanyl]-4,6-dimethylpyrimidine;5-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-4-propan-2-yl-1,3-thiazole
CID 159695349
2-chloro-5-methylpyridin-4-amine;N-[2-chloro-5-(trifluoromethyl)-4-pyridinyl]-5-pyrimidin-2-yl-1,3-thiazol-4-amine;5-pyrimidin-2-yl-1,3-thiazol-4-amine
CID 162263844
5-[2-(3-Chloro-2-pyridinyl)pyrimidin-4-yl]-4-methyl-2-pyridin-3-yl-1,3-thiazole
CID 58416088
5-[2-(6-Chloro-2-pyridinyl)pyrimidin-4-yl]-4-methyl-2-pyridin-3-yl-1,3-thiazole
CID 58416172
4-(3-Chlorophenyl)-2-piperidin-1-yl-5-[2-(1-pyridin-2-ylcyclopropyl)pyrimidin-4-yl]-1,3-thiazole
CID 69582336
4-(3-Chlorophenyl)-5-[2-(2-cyclopropyl-3-pyridinyl)pyrimidin-4-yl]-2-piperidin-1-yl-1,3-thiazole
CID 69582339
2-[2-(3-Chloro-2-pyridinyl)-6-pyrimidin-2-yl-3-pyridinyl]-1,3-thiazole
CID 90178330
6-chloro-2-(2-cyclopropylethyl)-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-5-methylpyrimidin-4-amine;ethane;pent-1-en-2-ylcyclopropane;propane;bis(pyridine)
CID 144356395
5-ethyl-2-propan-2-ylpyridine;3-ethyl-5-propan-2-yl-1,2,4-thiadiazole;4-ethyl-2-propan-2-yl-1,3-thiazole;5-ethyl-2-propan-2-yl-1,3-thiazole;1-methyl-1-(2-methylpropyl)cyclohexane;2-propan-2-yl-5-[(E)-prop-1-enyl]pyridine;2-propan-2-yl-5-[(E)-prop-1-enyl]pyrimidine;2-propan-2-yl-5-propylpyridine
CID 157098556
Methane;2-propan-2-ylpyrazine;bis(2-propan-2-ylpyridine);3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;2-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene
CID 157150242
2-Tert-butyl-3-chlorothiophene;4-tert-butyl-3,5-dimethylpyridine;4-tert-butyl-1-hydroxy-3,5-dimethylpyridin-1-ium;2-tert-butyl-3-methylpyridine;4-tert-butyl-5-methylpyrimidine;2-tert-butylpyrimidine;2-tert-butyl-1,3,4,5-tetramethylbenzene;2-tert-butyl-1,3-thiazole
CID 157452350

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole?
The IUPAC name of 2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole (CID 158353374) is 2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole.
What is the SMILES notation for 2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole?
The canonical SMILES for 2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole is CC1CC1(Cl)Cl.Cc1cc(Cl)ccn1.Cc1ccc(Cl)cn1.Cc1cccc(Cl)n1.Cc1ccccn1.Cc1cccnc1.Cc1ccncc1.Cc1ccncn1.Cc1csc(Cl)n1.Cc1cscn1.Cc1ncccc1Cl.Cc1ncccn1.
What is the InChIKey of 2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole?
The InChIKey is GSOXKZRYPVSTCK-UHFFFAOYSA-N. The full InChI is InChI=1S/4C6H6ClN.3C6H7N.2C5H6N2.C4H6Cl2.C4H4ClNS.C4H5NS/c1-5-4-6(7)2-3-8-5;1-5-2-3-6(7)4-8-5;1-5-6(7)3-2-4-8-5;1-5-3-2-4-6(7)8-5;1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;1-6-4-2-3-5-7-6;1-5-2-3-6-4-7-5;1-5-6-3-2-4-7-5;1-3-2-4(3,5)6;1-3-2-7-4(5)6-3;1-4-2-6-3-5-4/h4*2-4H,1H3;3*2-5H,1H3;2*2-4H,1H3;3H,2H2,1H3;2H,1H3;2-3H,1H3.
What are the key properties of 2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole?
2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole has a molecular weight of 1335.68 g/mol, XLogP of 19.67, 0 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-methylpyridine;3-chloro-2-methylpyridine;4-chloro-2-methylpyridine;5-chloro-2-methylpyridine;2-chloro-4-methyl-1,3-thiazole;1,1-dichloro-2-methylcyclopropane;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;4-methyl-1,3-thiazole is sourced from PubChem (CID 158353374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).