bis(2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine);2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;bis(2-tert-butyl-1,6-dimethylpyrrolo[3,2-c]pyridine);bis(2-tert-butyl-1,7-dimethylpyrrolo[2,3-c]pyridine);bis(2-tert-butyl-6-methylfuro[3,2-c]pyridine);bis(2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine);2-tert-butyl-6-methyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butyl-7-methyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-6-methylthieno[3,2-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;methane

C197H301Cl3N30O2S — CID 158855226

About bis(2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine);2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;bis(2-tert-butyl-1,6-dimethylpyrrolo[3,2-c]pyridine);bis(2-tert-butyl-1,7-dimethylpyrrolo[2,3-c]pyridine);bis(2-tert-butyl-6-methylfuro[3,2-c]pyridine);bis(2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine);2-tert-butyl-6-methyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butyl-7-methyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-6-methylthieno[3,2-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;methane

bis(2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine);2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;bis(2-tert-butyl-1,6-dimethylpyrrolo[3,2-c]pyridine);bis(2-tert-butyl-1,7-dimethylpyrrolo[2,3-c]pyridine);bis(2-tert-butyl-6-methylfuro[3,2-c]pyridine);bis(2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine);2-tert-butyl-6-methyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butyl-7-methyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-6-methylthieno[3,2-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;methane (PubChem CID 158855226) has the molecular formula C197H301Cl3N30O2S and a molecular weight of 3260.21 g/mol. Its IUPAC name is bis(2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine);2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;bis(2-tert-butyl-1,6-dimethylpyrrolo[3,2-c]pyridine);bis(2-tert-butyl-1,7-dimethylpyrrolo[2,3-c]pyridine);bis(2-tert-butyl-6-methylfuro[3,2-c]pyridine);bis(2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine);2-tert-butyl-6-methyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butyl-7-methyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-6-methylthieno[3,2-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;methane.

Molecular Properties

• Compound Name: bis(2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine);2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;bis(2-tert-butyl-1,6-dimethylpyrrolo[3,2-c]pyridine);bis(2-tert-butyl-1,7-dimethylpyrrolo[2,3-c]pyridine);bis(2-tert-butyl-6-methylfuro[3,2-c]pyridine);bis(2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine);2-tert-butyl-6-methyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butyl-7-methyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-6-methylthieno[3,2-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;methane
• PubChem CID: 158855226
• Molecular Formula: C197H301Cl3N30O2S
• Molecular Weight: 3260.21 g/mol
• Exact Mass: 3256.32
• IUPAC Name: bis(2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine);2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;bis(2-tert-butyl-1,6-dimethylpyrrolo[3,2-c]pyridine);bis(2-tert-butyl-1,7-dimethylpyrrolo[2,3-c]pyridine);bis(2-tert-butyl-6-methylfuro[3,2-c]pyridine);bis(2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine);2-tert-butyl-6-methyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butyl-7-methyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-6-methylthieno[3,2-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;methane
• SMILES: C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)(C)c1cc2c(N)cncc2[nH]1.CC(C)(C)c1cc2ccnc(Cl)c2[nH]1.Cc1cc2[nH]c(C(C)(C)C)cc2cn1.Cc1cc2c(cn1)cc(C(C)(C)C)n2C.Cc1cc2c(cn1)cc(C(C)(C)C)n2C.Cc1cc2oc(C(C)(C)C)cc2cn1.Cc1cc2oc(C(C)(C)C)cc2cn1.Cc1cc2sc(C(C)(C)C)cc2cn1.Cc1nccc2cc(C(C)(C)C)[nH]c12.Cc1nccc2cc(C(C)(C)C)n(C)c12.Cc1nccc2cc(C(C)(C)C)n(C)c12.Cn1c(C(C)(C)C)cc2c(N)cncc21.Cn1c(C(C)(C)C)cc2c(N)cncc21.Cn1c(C(C)(C)C)cc2ccnc(Cl)c21.Cn1c(C(C)(C)C)cc2ccnc(Cl)c21
• InChI: InChI=1S/4C13H18N2.2C12H15ClN2.2C12H17N3.2C12H16N2.2C12H15NO.C12H15NS.C11H13ClN2.C11H15N3.15CH4/c2*1-9-6-11-10(8-14-9)7-12(15(11)5)13(2,3)4;2*1-9-12-10(6-7-14-9)8-11(15(12)5)13(2,3)4;2*1-12(2,3)9-7-8-5-6-14-11(13)10(8)15(9)4;2*1-12(2,3)11-5-8-9(13)6-14-7-10(8)15(11)4;1-8-5-10-9(7-13-8)6-11(14-10)12(2,3)4;1-8-11-9(5-6-13-8)7-10(14-11)12(2,3)4;3*1-8-5-10-9(7-13-8)6-11(14-10)12(2,3)4;1-11(2,3)8-6-7-4-5-13-10(12)9(7)14-8;1-11(2,3)10-4-7-8(12)5-13-6-9(7)14-10;;;;;;;;;;;;;;;/h4*6-8H,1-5H3;2*5-7H,1-4H3;2*5-7H,13H2,1-4H3;2*5-7,14H,1-4H3;3*5-7H,1-4H3;4-6,14H,1-3H3;4-6,14H,12H2,1-3H3;15*1H4
• InChIKey: IZYQSBCDPGCLIW-UHFFFAOYSA-N
• XLogP: 57.28
• TPSA: 400.29 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 29
• Heavy Atoms: 233
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3260.21
LogP ≤ 5	57.28
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine);2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;bis(2-tert-butyl-1,6-dimethylpyrrolo[3,2-c]pyridine);bis(2-tert-butyl-1,7-dimethylpyrrolo[2,3-c]pyridine);bis(2-tert-butyl-6-methylfuro[3,2-c]pyridine);bis(2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine);2-tert-butyl-6-methyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butyl-7-methyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-6-methylthieno[3,2-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;methane?

The IUPAC name of bis(2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine);2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;bis(2-tert-butyl-1,6-dimethylpyrrolo[3,2-c]pyridine);bis(2-tert-butyl-1,7-dimethylpyrrolo[2,3-c]pyridine);bis(2-tert-butyl-6-methylfuro[3,2-c]pyridine);bis(2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine);2-tert-butyl-6-methyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butyl-7-methyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-6-methylthieno[3,2-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;methane (CID 158855226) is bis(2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine);2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;bis(2-tert-butyl-1,6-dimethylpyrrolo[3,2-c]pyridine);bis(2-tert-butyl-1,7-dimethylpyrrolo[2,3-c]pyridine);bis(2-tert-butyl-6-methylfuro[3,2-c]pyridine);bis(2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine);2-tert-butyl-6-methyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butyl-7-methyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-6-methylthieno[3,2-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;methane.

What is the SMILES notation for bis(2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine);2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;bis(2-tert-butyl-1,6-dimethylpyrrolo[3,2-c]pyridine);bis(2-tert-butyl-1,7-dimethylpyrrolo[2,3-c]pyridine);bis(2-tert-butyl-6-methylfuro[3,2-c]pyridine);bis(2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine);2-tert-butyl-6-methyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butyl-7-methyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-6-methylthieno[3,2-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;methane?

The canonical SMILES for bis(2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine);2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;bis(2-tert-butyl-1,6-dimethylpyrrolo[3,2-c]pyridine);bis(2-tert-butyl-1,7-dimethylpyrrolo[2,3-c]pyridine);bis(2-tert-butyl-6-methylfuro[3,2-c]pyridine);bis(2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine);2-tert-butyl-6-methyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butyl-7-methyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-6-methylthieno[3,2-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;methane is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)(C)c1cc2c(N)cncc2[nH]1.CC(C)(C)c1cc2ccnc(Cl)c2[nH]1.Cc1cc2[nH]c(C(C)(C)C)cc2cn1.Cc1cc2c(cn1)cc(C(C)(C)C)n2C.Cc1cc2c(cn1)cc(C(C)(C)C)n2C.Cc1cc2oc(C(C)(C)C)cc2cn1.Cc1cc2oc(C(C)(C)C)cc2cn1.Cc1cc2sc(C(C)(C)C)cc2cn1.Cc1nccc2cc(C(C)(C)C)[nH]c12.Cc1nccc2cc(C(C)(C)C)n(C)c12.Cc1nccc2cc(C(C)(C)C)n(C)c12.Cn1c(C(C)(C)C)cc2c(N)cncc21.Cn1c(C(C)(C)C)cc2c(N)cncc21.Cn1c(C(C)(C)C)cc2ccnc(Cl)c21.Cn1c(C(C)(C)C)cc2ccnc(Cl)c21.

What is the InChIKey of bis(2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine);2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;bis(2-tert-butyl-1,6-dimethylpyrrolo[3,2-c]pyridine);bis(2-tert-butyl-1,7-dimethylpyrrolo[2,3-c]pyridine);bis(2-tert-butyl-6-methylfuro[3,2-c]pyridine);bis(2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine);2-tert-butyl-6-methyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butyl-7-methyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-6-methylthieno[3,2-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;methane?

The InChIKey is IZYQSBCDPGCLIW-UHFFFAOYSA-N. The full InChI is InChI=1S/4C13H18N2.2C12H15ClN2.2C12H17N3.2C12H16N2.2C12H15NO.C12H15NS.C11H13ClN2.C11H15N3.15CH4/c2*1-9-6-11-10(8-14-9)7-12(15(11)5)13(2,3)4;2*1-9-12-10(6-7-14-9)8-11(15(12)5)13(2,3)4;2*1-12(2,3)9-7-8-5-6-14-11(13)10(8)15(9)4;2*1-12(2,3)11-5-8-9(13)6-14-7-10(8)15(11)4;1-8-5-10-9(7-13-8)6-11(14-10)12(2,3)4;1-8-11-9(5-6-13-8)7-10(14-11)12(2,3)4;3*1-8-5-10-9(7-13-8)6-11(14-10)12(2,3)4;1-11(2,3)8-6-7-4-5-13-10(12)9(7)14-8;1-11(2,3)10-4-7-8(12)5-13-6-9(7)14-10;;;;;;;;;;;;;;;/h4*6-8H,1-5H3;2*5-7H,1-4H3;2*5-7H,13H2,1-4H3;2*5-7,14H,1-4H3;3*5-7H,1-4H3;4-6,14H,1-3H3;4-6,14H,12H2,1-3H3;15*1H4.

What are the key properties of bis(2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine);2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;bis(2-tert-butyl-1,6-dimethylpyrrolo[3,2-c]pyridine);bis(2-tert-butyl-1,7-dimethylpyrrolo[2,3-c]pyridine);bis(2-tert-butyl-6-methylfuro[3,2-c]pyridine);bis(2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine);2-tert-butyl-6-methyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butyl-7-methyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-6-methylthieno[3,2-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;methane?

bis(2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine);2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;bis(2-tert-butyl-1,6-dimethylpyrrolo[3,2-c]pyridine);bis(2-tert-butyl-1,7-dimethylpyrrolo[2,3-c]pyridine);bis(2-tert-butyl-6-methylfuro[3,2-c]pyridine);bis(2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine);2-tert-butyl-6-methyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butyl-7-methyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-6-methylthieno[3,2-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;methane has a molecular weight of 3260.21 g/mol, XLogP of 57.28, 0 rotatable bonds, 7 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for bis(2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine);2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;bis(2-tert-butyl-1,6-dimethylpyrrolo[3,2-c]pyridine);bis(2-tert-butyl-1,7-dimethylpyrrolo[2,3-c]pyridine);bis(2-tert-butyl-6-methylfuro[3,2-c]pyridine);bis(2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine);2-tert-butyl-6-methyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butyl-7-methyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-6-methylthieno[3,2-c]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;methane is sourced from PubChem (CID 158855226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).