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

C21H25N5O — CID 44583590

IUPAC1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]imidazolidin-2-one
SMILESCc1cccc(C)c1CNc1cc(N2CCNC2=O)cn2c(C)c(C)nc12
InChIInChI=1S/C21H25N5O/c1-13-6-5-7-14(2)18(13)11-23-19-10-17(25-9-8-22-21(25)27)12-26-16(4)15(3)24-20(19)26/h5-7,10,12,23H,8-9,11H2,1-4H3,(H,22,27)
InChIKeyKOHDMWKBUVOITI-UHFFFAOYSA-N
MW363.47 g/mol
LogP3.71
Rot. Bonds4

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

1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]imidazolidin-2-one (PubChem CID 44583590) has the molecular formula C21H25N5O and a molecular weight of 363.47 g/mol. Its IUPAC name is 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]imidazolidin-2-one
PubChem CID44583590
Molecular FormulaC21H25N5O
Molecular Weight363.47 g/mol
Exact Mass363.21
IUPAC Name1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]imidazolidin-2-one
SMILESCc1cccc(C)c1CNc1cc(N2CCNC2=O)cn2c(C)c(C)nc12
InChIInChI=1S/C21H25N5O/c1-13-6-5-7-14(2)18(13)11-23-19-10-17(25-9-8-22-21(25)27)12-26-16(4)15(3)24-20(19)26/h5-7,10,12,23H,8-9,11H2,1-4H3,(H,22,27)
InChIKeyKOHDMWKBUVOITI-UHFFFAOYSA-N
XLogP3.71
TPSA61.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.47
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]imidazolidin-2-one?
The IUPAC name of 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]imidazolidin-2-one (CID 44583590) is 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]imidazolidin-2-one?
The canonical SMILES for 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]imidazolidin-2-one is Cc1cccc(C)c1CNc1cc(N2CCNC2=O)cn2c(C)c(C)nc12.
What is the InChIKey of 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]imidazolidin-2-one?
The InChIKey is KOHDMWKBUVOITI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O/c1-13-6-5-7-14(2)18(13)11-23-19-10-17(25-9-8-22-21(25)27)12-26-16(4)15(3)24-20(19)26/h5-7,10,12,23H,8-9,11H2,1-4H3,(H,22,27).
What are the key properties of 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]imidazolidin-2-one?
1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]imidazolidin-2-one has a molecular weight of 363.47 g/mol, XLogP of 3.71, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]imidazolidin-2-one is sourced from PubChem (CID 44583590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).