3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide

C14H18N4O2 — CID 95768805

IUPAC3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide
SMILESCC(C)c1cc(C(=O)N[C@H]2CCc3nccn3C2)on1
InChIInChI=1S/C14H18N4O2/c1-9(2)11-7-12(20-17-11)14(19)16-10-3-4-13-15-5-6-18(13)8-10/h5-7,9-10H,3-4,8H2,1-2H3,(H,16,19)/t10-/m0/s1
InChIKeyIJLDZNHBJLHKJM-JTQLQIEISA-N
MW274.32 g/mol
LogP1.74
Rot. Bonds3

About 3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide

3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide (PubChem CID 95768805) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide
PubChem CID95768805
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide
SMILESCC(C)c1cc(C(=O)N[C@H]2CCc3nccn3C2)on1
InChIInChI=1S/C14H18N4O2/c1-9(2)11-7-12(20-17-11)14(19)16-10-3-4-13-15-5-6-18(13)8-10/h5-7,9-10H,3-4,8H2,1-2H3,(H,16,19)/t10-/m0/s1
InChIKeyIJLDZNHBJLHKJM-JTQLQIEISA-N
XLogP1.74
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

US10800784, Example 21
CID 153311183
5-cyclopropyl-N-(3-imidazol-1-ylpropyl)-1,2-oxazole-3-carboxamide
CID 5309956
(3-Ethyl-1,2-oxazol-5-yl)-[3-(1-pyrimidin-2-ylpiperidin-4-yl)pyrrolidin-1-yl]methanone
CID 45232967
5-methyl-N-(2-(2-methyl-1H-imidazol-1-yl)ethyl)isoxazole-3-carboxamide
CID 49624776
N-(1-imidazol-1-ylpropan-2-yl)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazine-1-carboxamide
CID 53505695
5-isopropyl-N-[(1-methyl-1H-imidazol-2-yl)methyl]-N-propyl-3-isoxazolecarboxamide
CID 70777484
N-(1-imidazol-1-ylpropan-2-yl)-4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazine-1-carboxamide
CID 71892864
(5-Cyclopropyl-1,2-oxazol-3-yl)-[3-(2-ethylimidazol-1-yl)piperidin-1-yl]methanone
CID 72044150
N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-propan-2-yl-1,2-oxazole-5-carboxamide
CID 72135633
(5-Cyclopropyl-1,2-oxazol-3-yl)-[3-(2-propan-2-ylimidazol-1-yl)piperidin-1-yl]methanone
CID 72143160
N,N-dimethyl-3-(2-{1-[(5-methylisoxazol-3-yl)carbonyl]piperidin-4-yl}-1H-imidazol-1-yl)propan-1-amine
CID 72922510
3-(1H-imidazol-2-yl)-N-[(3-pentan-3-yl-1,2-oxazol-5-yl)methyl]piperidine-1-carboxamide
CID 84585206

Frequently Asked Questions

What is the IUPAC name of 3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide?
The IUPAC name of 3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide (CID 95768805) is 3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide?
The canonical SMILES for 3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide is CC(C)c1cc(C(=O)N[C@H]2CCc3nccn3C2)on1.
What is the InChIKey of 3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide?
The InChIKey is IJLDZNHBJLHKJM-JTQLQIEISA-N. The full InChI is InChI=1S/C14H18N4O2/c1-9(2)11-7-12(20-17-11)14(19)16-10-3-4-13-15-5-6-18(13)8-10/h5-7,9-10H,3-4,8H2,1-2H3,(H,16,19)/t10-/m0/s1.
What are the key properties of 3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide?
3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propan-2-yl-N-[(6S)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 95768805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).