(4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole

C14H17N3O — CID 165389534

IUPAC(4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole
SMILESCC(C)(C)[C@H]1COC(c2cn3ccccc3n2)=N1
InChIInChI=1S/C14H17N3O/c1-14(2,3)11-9-18-13(16-11)10-8-17-7-5-4-6-12(17)15-10/h4-8,11H,9H2,1-3H3/t11-/m1/s1
InChIKeyVSHOVICJGJLQNB-LLVKDONJSA-N
MW243.31 g/mol
LogP2.53
Rot. Bonds1

About (4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole

(4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole (PubChem CID 165389534) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is (4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole.

Molecular Properties

Compound Name(4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole
PubChem CID165389534
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name(4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole
SMILESCC(C)(C)[C@H]1COC(c2cn3ccccc3n2)=N1
InChIInChI=1S/C14H17N3O/c1-14(2,3)11-9-18-13(16-11)10-8-17-7-5-4-6-12(17)15-10/h4-8,11H,9H2,1-3H3/t11-/m1/s1
InChIKeyVSHOVICJGJLQNB-LLVKDONJSA-N
XLogP2.53
TPSA38.89 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole 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

(4S)-4-tert-butyl-2-(2-phenylphenyl)-4,5-dihydro-1,3-oxazole
CID 71232307
4-tert-butyl-2-(1,8-naphthyridin-2-yl)-4,5-dihydro-1,3-oxazole
CID 154729884
2-fluoroimidazo[1,2-a]pyridine
CID 68592134
2-(5-methylthiophen-2-yl)imidazo[1,2-a]pyridine
CID 22380806
[2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]pyrrol-1-yl]-bis(2-methylphenyl)phosphane
CID 101230843
(4S)-2-(1-benzothiophen-2-yl)-4-tert-butyl-4,5-dihydro-1,3-oxazole
CID 101234900
2-[4-(4-methylphenyl)phenyl]imidazo[1,2-a]pyridine
CID 58880683
(4S)-2-(1-bromonaphthalen-2-yl)-4-tert-butyl-4,5-dihydro-1,3-oxazole
CID 10404485
2-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine
CID 115403226
2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-thiazol-4-amine
CID 146351526
CID 134879893
CID 134879893
2-(2,2-dimethylpropyl)imidazo[1,2-a]pyridine
CID 59380864

Frequently Asked Questions

What is the IUPAC name of (4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole?
The IUPAC name of (4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole (CID 165389534) is (4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole.
What is the SMILES notation for (4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole?
The canonical SMILES for (4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole is CC(C)(C)[C@H]1COC(c2cn3ccccc3n2)=N1.
What is the InChIKey of (4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole?
The InChIKey is VSHOVICJGJLQNB-LLVKDONJSA-N. The full InChI is InChI=1S/C14H17N3O/c1-14(2,3)11-9-18-13(16-11)10-8-17-7-5-4-6-12(17)15-10/h4-8,11H,9H2,1-3H3/t11-/m1/s1.
What are the key properties of (4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole?
(4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole has a molecular weight of 243.31 g/mol, XLogP of 2.53, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-tert-butyl-2-imidazo[1,2-a]pyridin-2-yl-4,5-dihydro-1,3-oxazole is sourced from PubChem (CID 165389534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).