N-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde

C26H29N3O2 — CID 143295119

IUPACN-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde
SMILESC=O.COc1ccccc1-c1cc(NCc2c(C)cccc2C)c2nc(C)c(C)n2c1
InChIInChI=1S/C25H27N3O.CH2O/c1-16-9-8-10-17(2)22(16)14-26-23-13-20(21-11-6-7-12-24(21)29-5)15-28-19(4)18(3)27-25(23)28;1-2/h6-13,15,26H,14H2,1-5H3;1H2
InChIKeyKGGVONFJSSJJFV-UHFFFAOYSA-N
MW415.54 g/mol
LogP5.67
Rot. Bonds5

About N-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde

N-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde (PubChem CID 143295119) has the molecular formula C26H29N3O2 and a molecular weight of 415.54 g/mol. Its IUPAC name is N-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde.

Molecular Properties

Compound NameN-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde
PubChem CID143295119
Molecular FormulaC26H29N3O2
Molecular Weight415.54 g/mol
Exact Mass415.23
IUPAC NameN-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde
SMILESC=O.COc1ccccc1-c1cc(NCc2c(C)cccc2C)c2nc(C)c(C)n2c1
InChIInChI=1S/C25H27N3O.CH2O/c1-16-9-8-10-17(2)22(16)14-26-23-13-20(21-11-6-7-12-24(21)29-5)15-28-19(4)18(3)27-25(23)28;1-2/h6-13,15,26H,14H2,1-5H3;1H2
InChIKeyKGGVONFJSSJJFV-UHFFFAOYSA-N
XLogP5.67
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500415.54
LogP ≤ 55.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-1H-pyrimidine-2,4-dione;hydrochloride
CID 24889345
6-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide
CID 24890698
N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-(5-nitro-2-pyridinyl)imidazo[1,2-a]pyridin-8-amine
CID 59824141
8-[(2,6-dimethylphenyl)methylamino]-N-ethoxy-2,3-dimethylimidazo[1,2-a]pyridine-6-carboxamide
CID 150494948
N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridin-8-amine
CID 59824133
[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-[3-(2-methoxyethoxy)azetidin-1-yl]methanone
CID 138622201
[2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylphenyl] methyl carbonate;hydrochloride
CID 22672630
N-[(2,6-dimethylphenyl)methyl]-2,3-dimethyl-6-(5-methylimidazol-1-yl)imidazo[1,2-a]pyridin-8-amine;hydrochloride
CID 24890693
2-[2-[[(2,3-dimethylimidazo[1,2-a]pyridin-8-yl)amino]methyl]-3-methylphenoxy]ethanol
CID 22672577
[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-[3-(hydroxymethyl)-3-methylazetidin-1-yl]methanone
CID 138622200
[(2S)-1-[[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridine-6-carbonyl]amino]propan-2-yl] methanesulfonate
CID 87236278
(2R)-N-[8-[(2,6-dimethylphenyl)methylamino]-2,3-dimethylimidazo[1,2-a]pyridin-6-yl]-2,6-dihydroxy-4,8,11-trioxo-3,9,10-trioxabicyclo[4.3.2]undecane-2-carboxamide
CID 178065941

Frequently Asked Questions

What is the IUPAC name of N-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde?
The IUPAC name of N-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde (CID 143295119) is N-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde.
What is the SMILES notation for N-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde?
The canonical SMILES for N-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde is C=O.COc1ccccc1-c1cc(NCc2c(C)cccc2C)c2nc(C)c(C)n2c1.
What is the InChIKey of N-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde?
The InChIKey is KGGVONFJSSJJFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27N3O.CH2O/c1-16-9-8-10-17(2)22(16)14-26-23-13-20(21-11-6-7-12-24(21)29-5)15-28-19(4)18(3)27-25(23)28;1-2/h6-13,15,26H,14H2,1-5H3;1H2.
What are the key properties of N-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde?
N-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde has a molecular weight of 415.54 g/mol, XLogP of 5.67, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,6-dimethylphenyl)methyl]-6-(2-methoxyphenyl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine;formaldehyde is sourced from PubChem (CID 143295119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).