2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine

C18H20FN3O — CID 86282703

IUPAC2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine
SMILESCN(C)c1ccn2cc(-c3ccc(COCCF)cc3)nc2c1
InChIInChI=1S/C18H20FN3O/c1-21(2)16-7-9-22-12-17(20-18(22)11-16)15-5-3-14(4-6-15)13-23-10-8-19/h3-7,9,11-12H,8,10,13H2,1-2H3
InChIKeyAVIKYDDUGJWBRT-UHFFFAOYSA-N
MW313.38 g/mol
LogP3.55
Rot. Bonds6

About 2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine

2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine (PubChem CID 86282703) has the molecular formula C18H20FN3O and a molecular weight of 313.38 g/mol. Its IUPAC name is 2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine.

Molecular Properties

Compound Name2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine
PubChem CID86282703
Molecular FormulaC18H20FN3O
Molecular Weight313.38 g/mol
Exact Mass313.16
IUPAC Name2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine
SMILESCN(C)c1ccn2cc(-c3ccc(COCCF)cc3)nc2c1
InChIInChI=1S/C18H20FN3O/c1-21(2)16-7-9-22-12-17(20-18(22)11-16)15-5-3-14(4-6-15)13-23-10-8-19/h3-7,9,11-12H,8,10,13H2,1-2H3
InChIKeyAVIKYDDUGJWBRT-UHFFFAOYSA-N
XLogP3.55
TPSA29.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.38
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine?
The IUPAC name of 2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine (CID 86282703) is 2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine.
What is the SMILES notation for 2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine?
The canonical SMILES for 2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine is CN(C)c1ccn2cc(-c3ccc(COCCF)cc3)nc2c1.
What is the InChIKey of 2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine?
The InChIKey is AVIKYDDUGJWBRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN3O/c1-21(2)16-7-9-22-12-17(20-18(22)11-16)15-5-3-14(4-6-15)13-23-10-8-19/h3-7,9,11-12H,8,10,13H2,1-2H3.
What are the key properties of 2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine?
2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine has a molecular weight of 313.38 g/mol, XLogP of 3.55, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-fluoroethoxymethyl)phenyl]-N,N-dimethylimidazo[1,2-a]pyridin-7-amine is sourced from PubChem (CID 86282703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).