2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine

C21H28N4 — CID 861047

IUPAC2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1cccc2nc(-c3ccc(N(C)C)cc3)c(NCCC(C)C)n12
InChIInChI=1S/C21H28N4/c1-15(2)13-14-22-21-20(17-9-11-18(12-10-17)24(4)5)23-19-8-6-7-16(3)25(19)21/h6-12,15,22H,13-14H2,1-5H3
InChIKeyFSUSJTKCJRRFJF-UHFFFAOYSA-N
MW336.48 g/mol
LogP4.83
Rot. Bonds6

About 2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine

2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 861047) has the molecular formula C21H28N4 and a molecular weight of 336.48 g/mol. Its IUPAC name is 2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine
PubChem CID861047
Molecular FormulaC21H28N4
Molecular Weight336.48 g/mol
Exact Mass336.23
IUPAC Name2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1cccc2nc(-c3ccc(N(C)C)cc3)c(NCCC(C)C)n12
InChIInChI=1S/C21H28N4/c1-15(2)13-14-22-21-20(17-9-11-18(12-10-17)24(4)5)23-19-8-6-7-16(3)25(19)21/h6-12,15,22H,13-14H2,1-5H3
InChIKeyFSUSJTKCJRRFJF-UHFFFAOYSA-N
XLogP4.83
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.48
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine (CID 861047) is 2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine is Cc1cccc2nc(-c3ccc(N(C)C)cc3)c(NCCC(C)C)n12.
What is the InChIKey of 2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is FSUSJTKCJRRFJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N4/c1-15(2)13-14-22-21-20(17-9-11-18(12-10-17)24(4)5)23-19-8-6-7-16(3)25(19)21/h6-12,15,22H,13-14H2,1-5H3.
What are the key properties of 2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine?
2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 336.48 g/mol, XLogP of 4.83, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(dimethylamino)phenyl]-5-methyl-N-(3-methylbutyl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 861047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).