(2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide

C15H20BrN3O3 — CID 52531312

IUPAC(2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide
SMILESCCOCCO[C@H](C)C(=O)NCc1cn2cc(Br)ccc2n1
InChIInChI=1S/C15H20BrN3O3/c1-3-21-6-7-22-11(2)15(20)17-8-13-10-19-9-12(16)4-5-14(19)18-13/h4-5,9-11H,3,6-8H2,1-2H3,(H,17,20)/t11-/m1/s1
InChIKeyZEEHMUMVQIQEQV-LLVKDONJSA-N
MW370.25 g/mol
LogP2.15
Rot. Bonds8

About (2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide

(2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide (PubChem CID 52531312) has the molecular formula C15H20BrN3O3 and a molecular weight of 370.25 g/mol. Its IUPAC name is (2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide
PubChem CID52531312
Molecular FormulaC15H20BrN3O3
Molecular Weight370.25 g/mol
Exact Mass369.07
IUPAC Name(2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide
SMILESCCOCCO[C@H](C)C(=O)NCc1cn2cc(Br)ccc2n1
InChIInChI=1S/C15H20BrN3O3/c1-3-21-6-7-22-11(2)15(20)17-8-13-10-19-9-12(16)4-5-14(19)18-13/h4-5,9-11H,3,6-8H2,1-2H3,(H,17,20)/t11-/m1/s1
InChIKeyZEEHMUMVQIQEQV-LLVKDONJSA-N
XLogP2.15
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.25
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide?
The IUPAC name of (2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide (CID 52531312) is (2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide.
What is the SMILES notation for (2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide?
The canonical SMILES for (2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide is CCOCCO[C@H](C)C(=O)NCc1cn2cc(Br)ccc2n1.
What is the InChIKey of (2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide?
The InChIKey is ZEEHMUMVQIQEQV-LLVKDONJSA-N. The full InChI is InChI=1S/C15H20BrN3O3/c1-3-21-6-7-22-11(2)15(20)17-8-13-10-19-9-12(16)4-5-14(19)18-13/h4-5,9-11H,3,6-8H2,1-2H3,(H,17,20)/t11-/m1/s1.
What are the key properties of (2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide?
(2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide has a molecular weight of 370.25 g/mol, XLogP of 2.15, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(6-bromoimidazo[1,2-a]pyridin-2-yl)methyl]-2-(2-ethoxyethoxy)propanamide is sourced from PubChem (CID 52531312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).