6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane

C29H43Br3N8O2 — CID 159500213

IUPAC6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane
SMILESCCC.CN(C)/C=N/c1ccc(Br)cn1.COC(OC)N(C)C.Cc1cnc2ccc(Br)cn12.Nc1ccc(Br)cn1
InChIInChI=1S/C8H10BrN3.C8H7BrN2.C5H5BrN2.C5H13NO2.C3H8/c1-12(2)6-11-8-4-3-7(9)5-10-8;1-6-4-10-8-3-2-7(9)5-11(6)8;6-4-1-2-5(7)8-3-4;1-6(2)5(7-3)8-4;1-3-2/h3-6H,1-2H3;2-5H,1H3;1-3H,(H2,7,8);5H,1-4H3;3H2,1-2H3/b11-6+;;;;
InChIKeyLZHDOWVCUZPHCE-ZUXDPTBISA-N
MW775.43 g/mol
LogP7.44
Rot. Bonds5

About 6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane

6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane (PubChem CID 159500213) has the molecular formula C29H43Br3N8O2 and a molecular weight of 775.43 g/mol. Its IUPAC name is 6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane.

Molecular Properties

Compound Name6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane
PubChem CID159500213
Molecular FormulaC29H43Br3N8O2
Molecular Weight775.43 g/mol
Exact Mass772.11
IUPAC Name6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane
SMILESCCC.CN(C)/C=N/c1ccc(Br)cn1.COC(OC)N(C)C.Cc1cnc2ccc(Br)cn12.Nc1ccc(Br)cn1
InChIInChI=1S/C8H10BrN3.C8H7BrN2.C5H5BrN2.C5H13NO2.C3H8/c1-12(2)6-11-8-4-3-7(9)5-10-8;1-6-4-10-8-3-2-7(9)5-11(6)8;6-4-1-2-5(7)8-3-4;1-6(2)5(7-3)8-4;1-3-2/h3-6H,1-2H3;2-5H,1H3;1-3H,(H2,7,8);5H,1-4H3;3H2,1-2H3/b11-6+;;;;
InChIKeyLZHDOWVCUZPHCE-ZUXDPTBISA-N
XLogP7.44
TPSA106.40 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500775.43
LogP ≤ 57.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

4-(6-Bromoimidazo[1,2-a]pyridin-3-yl)pyrimidin-2-amine
CID 58221661
N-(5-bromo-2-pyridyl)-6-fluoro-5-(4-methylpiperazin-1-yl)-3H-imidazo[4,5-b]pyridin-2-amine
CID 118709838
6-bromo-2-imidazo[1,2-a]pyridin-6-yl-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine
CID 155568186
6-Bromo-2-(pyridin-2-yl)imidazo[1,2-a]pyridin-3-amine
CID 63617244
6-bromo-N-tert-butyl-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine
CID 809140
6-Bromo-2-(pyridin-2-YL)-N-(2,4,4-trimethylpentan-2-YL)imidazo[1,2-A]pyridin-3-amine
CID 3925373
6-bromo-N-(4-fluorophenyl)-2-(pyridin-2-yl)imidazo[1,2-a]pyridin-3-amine
CID 7338150
2-methoxy-N-[6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-yl]pyrimidin-5-amine
CID 118101407
9-[(5-Bromo-2-pyridinyl)methyl]-8-(5-fluoro-3-pyridinyl)-2-methoxy-6-methylpurine
CID 132077158
4-[[4-(6-Bromoimidazo[1,2-a]pyridin-3-yl)-5-fluoropyrimidin-2-yl]amino]piperidine-1-carboxylic acid
CID 135289692
4-(6-bromoimidazo[1,2-a]pyridin-3-yl)-5-fluoro-N-(1-methylpiperidin-4-yl)pyrimidin-2-amine
CID 135294135
Tert-butyl 4-[[4-(6-bromoimidazo[1,2-a]pyridin-3-yl)-5-fluoropyrimidin-2-yl]amino]piperidine-1-carboxylate
CID 153516819

Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane?
The IUPAC name of 6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane (CID 159500213) is 6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane.
What is the SMILES notation for 6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane?
The canonical SMILES for 6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane is CCC.CN(C)/C=N/c1ccc(Br)cn1.COC(OC)N(C)C.Cc1cnc2ccc(Br)cn12.Nc1ccc(Br)cn1.
What is the InChIKey of 6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane?
The InChIKey is LZHDOWVCUZPHCE-ZUXDPTBISA-N. The full InChI is InChI=1S/C8H10BrN3.C8H7BrN2.C5H5BrN2.C5H13NO2.C3H8/c1-12(2)6-11-8-4-3-7(9)5-10-8;1-6-4-10-8-3-2-7(9)5-11(6)8;6-4-1-2-5(7)8-3-4;1-6(2)5(7-3)8-4;1-3-2/h3-6H,1-2H3;2-5H,1H3;1-3H,(H2,7,8);5H,1-4H3;3H2,1-2H3/b11-6+;;;;.
What are the key properties of 6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane?
6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane has a molecular weight of 775.43 g/mol, XLogP of 7.44, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-methylimidazo[1,2-a]pyridine;5-bromopyridin-2-amine;N'-(5-bromo-2-pyridinyl)-N,N-dimethylmethanimidamide;1,1-dimethoxy-N,N-dimethylmethanamine;propane is sourced from PubChem (CID 159500213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).