3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine

C14H22N4O — CID 55237360

IUPAC3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine
SMILESCOCCCN(C)c1nc2ccccn2c1CCN
InChIInChI=1S/C14H22N4O/c1-17(9-5-11-19-2)14-12(7-8-15)18-10-4-3-6-13(18)16-14/h3-4,6,10H,5,7-9,11,15H2,1-2H3
InChIKeyJWWHKLVWPULPTG-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.31
Rot. Bonds7

About 3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine

3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine (PubChem CID 55237360) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine.

Molecular Properties

Compound Name3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine
PubChem CID55237360
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine
SMILESCOCCCN(C)c1nc2ccccn2c1CCN
InChIInChI=1S/C14H22N4O/c1-17(9-5-11-19-2)14-12(7-8-15)18-10-4-3-6-13(18)16-14/h3-4,6,10H,5,7-9,11,15H2,1-2H3
InChIKeyJWWHKLVWPULPTG-UHFFFAOYSA-N
XLogP1.31
TPSA55.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.31
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 3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine?
The IUPAC name of 3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine (CID 55237360) is 3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine.
What is the SMILES notation for 3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine?
The canonical SMILES for 3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine is COCCCN(C)c1nc2ccccn2c1CCN.
What is the InChIKey of 3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine?
The InChIKey is JWWHKLVWPULPTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-17(9-5-11-19-2)14-12(7-8-15)18-10-4-3-6-13(18)16-14/h3-4,6,10H,5,7-9,11,15H2,1-2H3.
What are the key properties of 3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine?
3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine has a molecular weight of 262.36 g/mol, XLogP of 1.31, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminoethyl)-N-(3-methoxypropyl)-N-methylimidazo[1,2-a]pyridin-2-amine is sourced from PubChem (CID 55237360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).