7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine

C29H30N4O — CID 157176427

IUPAC7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine
SMILESCc1ccc(CCc2nc3cc(-c4c(C)noc4C)ccn3c2N[C@H](C)c2ccccc2)cc1
InChIInChI=1S/C29H30N4O/c1-19-10-12-23(13-11-19)14-15-26-29(30-20(2)24-8-6-5-7-9-24)33-17-16-25(18-27(33)31-26)28-21(3)32-34-22(28)4/h5-13,16-18,20,30H,14-15H2,1-4H3/t20-/m1/s1
InChIKeyLEPWTHQZISVWNB-HXUWFJFHSA-N
MW450.59 g/mol
LogP6.87
Rot. Bonds7

About 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine

7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine (PubChem CID 157176427) has the molecular formula C29H30N4O and a molecular weight of 450.59 g/mol. Its IUPAC name is 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine
PubChem CID157176427
Molecular FormulaC29H30N4O
Molecular Weight450.59 g/mol
Exact Mass450.24
IUPAC Name7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine
SMILESCc1ccc(CCc2nc3cc(-c4c(C)noc4C)ccn3c2N[C@H](C)c2ccccc2)cc1
InChIInChI=1S/C29H30N4O/c1-19-10-12-23(13-11-19)14-15-26-29(30-20(2)24-8-6-5-7-9-24)33-17-16-25(18-27(33)31-26)28-21(3)32-34-22(28)4/h5-13,16-18,20,30H,14-15H2,1-4H3/t20-/m1/s1
InChIKeyLEPWTHQZISVWNB-HXUWFJFHSA-N
XLogP6.87
TPSA55.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500450.59
LogP ≤ 56.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]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

Related Compounds

tert-butyl 2-[[7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-(2-phenylethyl)imidazo[1,2-a]pyridin-3-yl]amino]acetate
CID 146588960
7-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2-morpholin-4-ylethyl)-2-(2-phenylethyl)imidazo[1,2-a]pyridin-3-amine
CID 146589043
N-(1-adamantyl)-7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]imidazo[1,2-a]pyridin-3-amine
CID 146524803
N-[4-[2-[3-(cyclohexylamino)-7-(3,5-dimethyl-1,2-oxazol-4-yl)imidazo[1,2-a]pyridin-2-yl]ethyl]phenyl]-3-[2-[2-[2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]ethoxy]ethoxy]ethoxy]propanamide
CID 164835729
4-(1-benzylindol-6-yl)-3,5-dimethyl-1,2-oxazole
CID 156790239
N-[4-[2-[3-(cyclohexylamino)-7-(3,5-dimethyl-1,2-oxazol-4-yl)imidazo[1,2-a]pyridin-2-yl]ethyl]phenyl]-8-[[2-(2,4-dioxocyclohexyl)-1,3-dioxoisoindol-4-yl]amino]octanamide
CID 167660724
5-[2-(4-methylphenyl)ethyl]-4-N-(1-phenylethyl)pyrimidine-2,4-diamine
CID 69020793
3,5-dimethyl-4-(4-methylphenyl)-1,2-oxazole;ethane
CID 142046789
3,5-dimethyl-4-[4-methyl-3-[[4-(1,2,4-triazol-4-yl)phenyl]methyl]phenyl]-1,2-oxazole
CID 167674168
1-(4-chlorophenyl)-3-[7-methyl-2-(2-phenylethyl)imidazo[1,2-a]pyridin-3-yl]urea
CID 42694847
3,5-dimethyl-4-(4-propan-2-ylphenyl)-1,2-oxazole
CID 58670338
2-[4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[phenyl(pyridin-2-yl)methyl]indazol-3-yl]phenyl]acetic acid
CID 118937106

Frequently Asked Questions

What is the IUPAC name of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine (CID 157176427) is 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine is Cc1ccc(CCc2nc3cc(-c4c(C)noc4C)ccn3c2N[C@H](C)c2ccccc2)cc1.
What is the InChIKey of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine?
The InChIKey is LEPWTHQZISVWNB-HXUWFJFHSA-N. The full InChI is InChI=1S/C29H30N4O/c1-19-10-12-23(13-11-19)14-15-26-29(30-20(2)24-8-6-5-7-9-24)33-17-16-25(18-27(33)31-26)28-21(3)32-34-22(28)4/h5-13,16-18,20,30H,14-15H2,1-4H3/t20-/m1/s1.
What are the key properties of 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine?
7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine has a molecular weight of 450.59 g/mol, XLogP of 6.87, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methylphenyl)ethyl]-N-[(1R)-1-phenylethyl]imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 157176427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).