N-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide

C19H20F2N4O2 — CID 90132540

IUPACN-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1cc(OCc2c(F)cccc2F)c2nc(C)c(C(=O)NCCN)n2c1
InChIInChI=1S/C19H20F2N4O2/c1-11-8-16(27-10-13-14(20)4-3-5-15(13)21)18-24-12(2)17(25(18)9-11)19(26)23-7-6-22/h3-5,8-9H,6-7,10,22H2,1-2H3,(H,23,26)
InChIKeyDQDOJOXHYPGNQS-UHFFFAOYSA-N
MW374.39 g/mol
LogP2.50
Rot. Bonds6

About N-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide

N-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 90132540) has the molecular formula C19H20F2N4O2 and a molecular weight of 374.39 g/mol. Its IUPAC name is N-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID90132540
Molecular FormulaC19H20F2N4O2
Molecular Weight374.39 g/mol
Exact Mass374.16
IUPAC NameN-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1cc(OCc2c(F)cccc2F)c2nc(C)c(C(=O)NCCN)n2c1
InChIInChI=1S/C19H20F2N4O2/c1-11-8-16(27-10-13-14(20)4-3-5-15(13)21)18-24-12(2)17(25(18)9-11)19(26)23-7-6-22/h3-5,8-9H,6-7,10,22H2,1-2H3,(H,23,26)
InChIKeyDQDOJOXHYPGNQS-UHFFFAOYSA-N
XLogP2.50
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.39
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide (CID 90132540) is N-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide is Cc1cc(OCc2c(F)cccc2F)c2nc(C)c(C(=O)NCCN)n2c1.
What is the InChIKey of N-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is DQDOJOXHYPGNQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F2N4O2/c1-11-8-16(27-10-13-14(20)4-3-5-15(13)21)18-24-12(2)17(25(18)9-11)19(26)23-7-6-22/h3-5,8-9H,6-7,10,22H2,1-2H3,(H,23,26).
What are the key properties of N-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
N-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 374.39 g/mol, XLogP of 2.50, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-8-[(2,6-difluorophenyl)methoxy]-2,6-dimethylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 90132540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).