6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine

C17H21BrN6O — CID 155524846

IUPAC6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1ncc(-c2nc3ccc(Br)cn3c2NCCN2CCOCC2)[nH]1
InChIInChI=1S/C17H21BrN6O/c1-12-20-10-14(21-12)16-17(19-4-5-23-6-8-25-9-7-23)24-11-13(18)2-3-15(24)22-16/h2-3,10-11,19H,4-9H2,1H3,(H,20,21)
InChIKeyAKNJRBMWSUVRIM-UHFFFAOYSA-N
MW405.30 g/mol
LogP2.54
Rot. Bonds5

About 6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine

6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 155524846) has the molecular formula C17H21BrN6O and a molecular weight of 405.30 g/mol. Its IUPAC name is 6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine
PubChem CID155524846
Molecular FormulaC17H21BrN6O
Molecular Weight405.30 g/mol
Exact Mass404.10
IUPAC Name6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1ncc(-c2nc3ccc(Br)cn3c2NCCN2CCOCC2)[nH]1
InChIInChI=1S/C17H21BrN6O/c1-12-20-10-14(21-12)16-17(19-4-5-23-6-8-25-9-7-23)24-11-13(18)2-3-15(24)22-16/h2-3,10-11,19H,4-9H2,1H3,(H,20,21)
InChIKeyAKNJRBMWSUVRIM-UHFFFAOYSA-N
XLogP2.54
TPSA70.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.30
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

7-bromo-3-(2-morpholin-4-ylethylamino)pyrido[1,2-a]pyrimidin-4-one
CID 118613302
hydrazinyl-[2-(5-methyl-1H-imidazol-4-yl)-3-(2-morpholin-4-ylethylamino)imidazo[1,2-a]pyridin-6-yl]methanol
CID 174193595
N-[(2-methyl-1H-imidazol-5-yl)methyl]-2-morpholin-4-ylethanamine
CID 62742690
methyl 2-(5-methyl-3H-pyrrol-4-yl)-3-(2-morpholin-4-ylethylamino)imidazo[1,2-a]pyridine-6-carboxylate;2-(5-methyl-3H-pyrrol-4-yl)-3-(2-morpholin-4-ylethylamino)imidazo[1,2-a]pyridine-6-carboxylic acid
CID 159951639
3-bromo-N-(2-morpholin-4-ylethyl)quinolin-8-amine
CID 116784312
5-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine
CID 23551658
5-bromo-4-methyl-N-(2-morpholin-4-ylethyl)pyridin-2-amine
CID 113340018
4-N-(4-bromo-2-methylphenyl)-6-N-(2-morpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 112857691
6-bromo-N-(2-morpholin-4-ylethyl)quinazolin-4-amine
CID 728957
ethane;5-methyl-N-(2-morpholin-4-ylethyl)-1,3-thiazol-2-amine
CID 143962241
N-[(2-methyl-1H-imidazol-5-yl)methyl]-3-morpholin-4-ylpropan-1-amine
CID 62742878
5-[3-(4-methylphenyl)imidazo[1,2-a]pyrazin-6-yl]-N-(2-morpholin-4-ylethyl)pyridin-2-amine
CID 140905207

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine (CID 155524846) is 6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine is Cc1ncc(-c2nc3ccc(Br)cn3c2NCCN2CCOCC2)[nH]1.
What is the InChIKey of 6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is AKNJRBMWSUVRIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21BrN6O/c1-12-20-10-14(21-12)16-17(19-4-5-23-6-8-25-9-7-23)24-11-13(18)2-3-15(24)22-16/h2-3,10-11,19H,4-9H2,1H3,(H,20,21).
What are the key properties of 6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine?
6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 405.30 g/mol, XLogP of 2.54, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(2-methyl-1H-imidazol-5-yl)-N-(2-morpholin-4-ylethyl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 155524846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).