6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine

C55H64Br2N12O7 — CID 158850832

IUPAC6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine
SMILESCc1cccc(-c2ccccc2-c2ccc3ncc(C(=O)NCCN4CCOCC4)n3c2)n1.NCCN1CCOCC1.O=C(CCCN1CCOCC1)c1cnc2ccc(Br)cn12.O=C(O)c1cnc2ccc(Br)cn12
InChIInChI=1S/C26H27N5O2.C15H18BrN3O2.C8H5BrN2O2.C6H14N2O/c1-19-5-4-8-23(29-19)22-7-3-2-6-21(22)20-9-10-25-28-17-24(31(25)18-20)26(32)27-11-12-30-13-15-33-16-14-30;16-12-3-4-15-17-10-13(19(15)11-12)14(20)2-1-5-18-6-8-21-9-7-18;9-5-1-2-7-10-3-6(8(12)13)11(7)4-5;7-1-2-8-3-5-9-6-4-8/h2-10,17-18H,11-16H2,1H3,(H,27,32);3-4,10-11H,1-2,5-9H2;1-4H,(H,12,13);1-7H2
InChIKeyIZKUAVWGFRDAAC-UHFFFAOYSA-N
MW1165.00 g/mol
LogP6.90
Rot. Bonds14

About 6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine

6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine (PubChem CID 158850832) has the molecular formula C55H64Br2N12O7 and a molecular weight of 1165.00 g/mol. Its IUPAC name is 6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine.

Molecular Properties

Compound Name6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine
PubChem CID158850832
Molecular FormulaC55H64Br2N12O7
Molecular Weight1165.00 g/mol
Exact Mass1162.34
IUPAC Name6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine
SMILESCc1cccc(-c2ccccc2-c2ccc3ncc(C(=O)NCCN4CCOCC4)n3c2)n1.NCCN1CCOCC1.O=C(CCCN1CCOCC1)c1cnc2ccc(Br)cn12.O=C(O)c1cnc2ccc(Br)cn12
InChIInChI=1S/C26H27N5O2.C15H18BrN3O2.C8H5BrN2O2.C6H14N2O/c1-19-5-4-8-23(29-19)22-7-3-2-6-21(22)20-9-10-25-28-17-24(31(25)18-20)26(32)27-11-12-30-13-15-33-16-14-30;16-12-3-4-15-17-10-13(19(15)11-12)14(20)2-1-5-18-6-8-21-9-7-18;9-5-1-2-7-10-3-6(8(12)13)11(7)4-5;7-1-2-8-3-5-9-6-4-8/h2-10,17-18H,11-16H2,1H3,(H,27,32);3-4,10-11H,1-2,5-9H2;1-4H,(H,12,13);1-7H2
InChIKeyIZKUAVWGFRDAAC-UHFFFAOYSA-N
XLogP6.90
TPSA211.69 Ų
H-Bond Donors3
H-Bond Acceptors17
Rotatable Bonds14
Heavy Atoms76
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001165.00
LogP ≤ 56.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1017

Analyze 6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine?
The IUPAC name of 6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine (CID 158850832) is 6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine.
What is the SMILES notation for 6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine?
The canonical SMILES for 6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine is Cc1cccc(-c2ccccc2-c2ccc3ncc(C(=O)NCCN4CCOCC4)n3c2)n1.NCCN1CCOCC1.O=C(CCCN1CCOCC1)c1cnc2ccc(Br)cn12.O=C(O)c1cnc2ccc(Br)cn12.
What is the InChIKey of 6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine?
The InChIKey is IZKUAVWGFRDAAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N5O2.C15H18BrN3O2.C8H5BrN2O2.C6H14N2O/c1-19-5-4-8-23(29-19)22-7-3-2-6-21(22)20-9-10-25-28-17-24(31(25)18-20)26(32)27-11-12-30-13-15-33-16-14-30;16-12-3-4-15-17-10-13(19(15)11-12)14(20)2-1-5-18-6-8-21-9-7-18;9-5-1-2-7-10-3-6(8(12)13)11(7)4-5;7-1-2-8-3-5-9-6-4-8/h2-10,17-18H,11-16H2,1H3,(H,27,32);3-4,10-11H,1-2,5-9H2;1-4H,(H,12,13);1-7H2.
What are the key properties of 6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine?
6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine has a molecular weight of 1165.00 g/mol, XLogP of 6.90, 14 rotatable bonds, 3 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromoimidazo[1,2-a]pyridine-3-carboxylic acid;1-(6-bromoimidazo[1,2-a]pyridin-3-yl)-4-morpholin-4-ylbutan-1-one;6-[2-(6-methyl-2-pyridinyl)phenyl]-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;2-morpholin-4-ylethanamine is sourced from PubChem (CID 158850832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).