N-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine

C27H24N4O — CID 5241001

IUPACN-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine
SMILESCc1cccc(C)c1Nc1c(-c2ccccn2)nc2c(OCc3ccccc3)cccn12
InChIInChI=1S/C27H24N4O/c1-19-10-8-11-20(2)24(19)29-27-25(22-14-6-7-16-28-22)30-26-23(15-9-17-31(26)27)32-18-21-12-4-3-5-13-21/h3-17,29H,18H2,1-2H3
InChIKeyVYAZOBUVZNNLEB-UHFFFAOYSA-N
MW420.52 g/mol
LogP6.34
Rot. Bonds6

About N-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine

N-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine (PubChem CID 5241001) has the molecular formula C27H24N4O and a molecular weight of 420.52 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine
PubChem CID5241001
Molecular FormulaC27H24N4O
Molecular Weight420.52 g/mol
Exact Mass420.20
IUPAC NameN-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine
SMILESCc1cccc(C)c1Nc1c(-c2ccccn2)nc2c(OCc3ccccc3)cccn12
InChIInChI=1S/C27H24N4O/c1-19-10-8-11-20(2)24(19)29-27-25(22-14-6-7-16-28-22)30-26-23(15-9-17-31(26)27)32-18-21-12-4-3-5-13-21/h3-17,29H,18H2,1-2H3
InChIKeyVYAZOBUVZNNLEB-UHFFFAOYSA-N
XLogP6.34
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500420.52
LogP ≤ 56.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het_65_Db(5)', 'substructure': 'N/A'}

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Related Compounds

N-(2,6-dimethylphenyl)-2-(2-phenylethyl)-8-phenylmethoxyimidazo[1,2-a]pyridin-3-amine
CID 3939760
N-benzyl-2-(2-methylphenyl)-8-phenylmethoxyimidazo[1,2-a]pyridin-3-amine
CID 3532130
N-benzyl-2-(3-methylphenyl)-8-phenylmethoxyimidazo[1,2-a]pyridin-3-amine
CID 3619073
ethyl 2-[(2-phenyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)amino]acetate
CID 42738205
N-tert-butyl-2-(2-fluorophenyl)-8-phenylmethoxyimidazo[1,2-a]pyridin-3-amine
CID 4644219
N-tert-butyl-2-(2-phenylethyl)-8-phenylmethoxyimidazo[1,2-a]pyridin-3-amine
CID 4031858
N-benzyl-2-(4-nitrophenyl)-8-phenylmethoxyimidazo[1,2-a]pyridin-3-amine
CID 42738330
N-(2,6-dimethylphenyl)-5,7-dimethyl-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine
CID 809365
N-(3-methoxyphenyl)-2-[5-(2-phenylethynyl)thiophen-2-yl]-8-phenylmethoxyimidazo[1,2-a]pyridin-3-amine
CID 11613407
N-cyclohexyl-2-(furan-2-yl)-8-phenylmethoxyimidazo[1,2-a]pyridin-3-amine
CID 3472024
3-bromo-2-(4-methoxyphenyl)-8-phenylmethoxyimidazo[1,2-a]pyridine
CID 101390623
2-(2-methyl-8-phenylmethoxyimidazo[1,2-a]pyridin-3-yl)propanoic acid
CID 57261502

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of N-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine (CID 5241001) is N-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for N-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for N-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine is Cc1cccc(C)c1Nc1c(-c2ccccn2)nc2c(OCc3ccccc3)cccn12.
What is the InChIKey of N-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is VYAZOBUVZNNLEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24N4O/c1-19-10-8-11-20(2)24(19)29-27-25(22-14-6-7-16-28-22)30-26-23(15-9-17-31(26)27)32-18-21-12-4-3-5-13-21/h3-17,29H,18H2,1-2H3.
What are the key properties of N-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine?
N-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 420.52 g/mol, XLogP of 6.34, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-8-phenylmethoxy-2-pyridin-2-ylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 5241001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).