N-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine

C24H25FN6 — CID 24746383

IUPACN-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine
SMILESCN(C)Cc1ccn2c(-c3ccnc(NC4CCC4)n3)c(-c3ccc(F)cc3)nc2c1
InChIInChI=1S/C24H25FN6/c1-30(2)15-16-11-13-31-21(14-16)29-22(17-6-8-18(25)9-7-17)23(31)20-10-12-26-24(28-20)27-19-4-3-5-19/h6-14,19H,3-5,15H2,1-2H3,(H,26,27,28)
InChIKeyCYRCKQIARKMPCT-UHFFFAOYSA-N
MW416.50 g/mol
LogP4.62
Rot. Bonds6

About N-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine

N-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine (PubChem CID 24746383) has the molecular formula C24H25FN6 and a molecular weight of 416.50 g/mol. Its IUPAC name is N-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine.

Molecular Properties

Compound NameN-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine
PubChem CID24746383
Molecular FormulaC24H25FN6
Molecular Weight416.50 g/mol
Exact Mass416.21
IUPAC NameN-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine
SMILESCN(C)Cc1ccn2c(-c3ccnc(NC4CCC4)n3)c(-c3ccc(F)cc3)nc2c1
InChIInChI=1S/C24H25FN6/c1-30(2)15-16-11-13-31-21(14-16)29-22(17-6-8-18(25)9-7-17)23(31)20-10-12-26-24(28-20)27-19-4-3-5-19/h6-14,19H,3-5,15H2,1-2H3,(H,26,27,28)
InChIKeyCYRCKQIARKMPCT-UHFFFAOYSA-N
XLogP4.62
TPSA58.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.50
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-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 N-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine?
The IUPAC name of N-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine (CID 24746383) is N-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine.
What is the SMILES notation for N-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine?
The canonical SMILES for N-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine is CN(C)Cc1ccn2c(-c3ccnc(NC4CCC4)n3)c(-c3ccc(F)cc3)nc2c1.
What is the InChIKey of N-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine?
The InChIKey is CYRCKQIARKMPCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25FN6/c1-30(2)15-16-11-13-31-21(14-16)29-22(17-6-8-18(25)9-7-17)23(31)20-10-12-26-24(28-20)27-19-4-3-5-19/h6-14,19H,3-5,15H2,1-2H3,(H,26,27,28).
What are the key properties of N-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine?
N-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine has a molecular weight of 416.50 g/mol, XLogP of 4.62, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-4-[7-[(dimethylamino)methyl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine is sourced from PubChem (CID 24746383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).