N-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine

C11H15N3O2 — CID 107390183

IUPACN-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine
SMILESCOC(CNc1cccc2nccn12)OC
InChIInChI=1S/C11H15N3O2/c1-15-11(16-2)8-13-10-5-3-4-9-12-6-7-14(9)10/h3-7,11,13H,8H2,1-2H3
InChIKeyCZFBBWYSLVOHFJ-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.37
Rot. Bonds5

About N-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine

N-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine (PubChem CID 107390183) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine.

Molecular Properties

Compound NameN-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine
PubChem CID107390183
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC NameN-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine
SMILESCOC(CNc1cccc2nccn12)OC
InChIInChI=1S/C11H15N3O2/c1-15-11(16-2)8-13-10-5-3-4-9-12-6-7-14(9)10/h3-7,11,13H,8H2,1-2H3
InChIKeyCZFBBWYSLVOHFJ-UHFFFAOYSA-N
XLogP1.37
TPSA47.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine?
The IUPAC name of N-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine (CID 107390183) is N-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine.
What is the SMILES notation for N-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine?
The canonical SMILES for N-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine is COC(CNc1cccc2nccn12)OC.
What is the InChIKey of N-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine?
The InChIKey is CZFBBWYSLVOHFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-15-11(16-2)8-13-10-5-3-4-9-12-6-7-14(9)10/h3-7,11,13H,8H2,1-2H3.
What are the key properties of N-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine?
N-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine has a molecular weight of 221.26 g/mol, XLogP of 1.37, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethoxyethyl)imidazo[1,2-a]pyridin-5-amine is sourced from PubChem (CID 107390183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).