1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one

C22H22N4O2 — CID 44583633

IUPAC1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one
SMILESCOc1ccccc1CNc1cc(-n2ccccc2=O)cn2c(C)c(C)nc12
InChIInChI=1S/C22H22N4O2/c1-15-16(2)26-14-18(25-11-7-6-10-21(25)27)12-19(22(26)24-15)23-13-17-8-4-5-9-20(17)28-3/h4-12,14,23H,13H2,1-3H3
InChIKeyIXGNTQQGMMPWEG-UHFFFAOYSA-N
MW374.44 g/mol
LogP3.72
Rot. Bonds5

About 1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one

1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one (PubChem CID 44583633) has the molecular formula C22H22N4O2 and a molecular weight of 374.44 g/mol. Its IUPAC name is 1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one.

Molecular Properties

Compound Name1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one
PubChem CID44583633
Molecular FormulaC22H22N4O2
Molecular Weight374.44 g/mol
Exact Mass374.17
IUPAC Name1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one
SMILESCOc1ccccc1CNc1cc(-n2ccccc2=O)cn2c(C)c(C)nc12
InChIInChI=1S/C22H22N4O2/c1-15-16(2)26-14-18(25-11-7-6-10-21(25)27)12-19(22(26)24-15)23-13-17-8-4-5-9-20(17)28-3/h4-12,14,23H,13H2,1-3H3
InChIKeyIXGNTQQGMMPWEG-UHFFFAOYSA-N
XLogP3.72
TPSA60.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one?
The IUPAC name of 1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one (CID 44583633) is 1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one.
What is the SMILES notation for 1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one?
The canonical SMILES for 1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one is COc1ccccc1CNc1cc(-n2ccccc2=O)cn2c(C)c(C)nc12.
What is the InChIKey of 1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one?
The InChIKey is IXGNTQQGMMPWEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O2/c1-15-16(2)26-14-18(25-11-7-6-10-21(25)27)12-19(22(26)24-15)23-13-17-8-4-5-9-20(17)28-3/h4-12,14,23H,13H2,1-3H3.
What are the key properties of 1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one?
1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one has a molecular weight of 374.44 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[8-[(2-methoxyphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridin-2-one is sourced from PubChem (CID 44583633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).