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

C16H22N4O2 — CID 95776370

IUPAC3-[(2S)-butan-2-yl]-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide
SMILESCC[C@H](C)c1cc(C(=O)N[C@H]2CCc3nc(C)cn3C2)on1
InChIInChI=1S/C16H22N4O2/c1-4-10(2)13-7-14(22-19-13)16(21)18-12-5-6-15-17-11(3)8-20(15)9-12/h7-8,10,12H,4-6,9H2,1-3H3,(H,18,21)/t10-,12-/m0/s1
InChIKeyYDNBOHRFHTWAJB-JQWIXIFHSA-N
MW302.38 g/mol
LogP2.44
Rot. Bonds4

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

3-[(2S)-butan-2-yl]-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide (PubChem CID 95776370) has the molecular formula C16H22N4O2 and a molecular weight of 302.38 g/mol. Its IUPAC name is 3-[(2S)-butan-2-yl]-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name3-[(2S)-butan-2-yl]-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide
PubChem CID95776370
Molecular FormulaC16H22N4O2
Molecular Weight302.38 g/mol
Exact Mass302.17
IUPAC Name3-[(2S)-butan-2-yl]-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide
SMILESCC[C@H](C)c1cc(C(=O)N[C@H]2CCc3nc(C)cn3C2)on1
InChIInChI=1S/C16H22N4O2/c1-4-10(2)13-7-14(22-19-13)16(21)18-12-5-6-15-17-11(3)8-20(15)9-12/h7-8,10,12H,4-6,9H2,1-3H3,(H,18,21)/t10-,12-/m0/s1
InChIKeyYDNBOHRFHTWAJB-JQWIXIFHSA-N
XLogP2.44
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-[(2S)-butan-2-yl]-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide with MolForge

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Related Compounds

3-[(2S)-butan-2-yl]-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide
CID 95776356
3-methyl-N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-5-propan-2-yl-1,2-oxazole-4-carboxamide
CID 86772586
(2R)-2-(2-methoxyethoxy)-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]propanamide
CID 95769272
(2S)-2-ethoxy-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]propanamide
CID 95765907
(2S)-2-methoxy-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]propanamide
CID 95765991
(2S)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]propanamide
CID 95765985
2,5-dimethyl-N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]thiophene-3-carboxamide
CID 95136799
2-methyl-N-pentan-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
CID 115715531
2-(2,5-dimethylphenyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95737521
(2S)-2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-methyl-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]butanamide
CID 129448698
2-(2-methylpropyl)-N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-6-oxo-1H-pyridine-4-carboxamide
CID 75446950
2-(3-methylphenyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95788774

Frequently Asked Questions

What is the IUPAC name of 3-[(2S)-butan-2-yl]-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide?
The IUPAC name of 3-[(2S)-butan-2-yl]-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide (CID 95776370) is 3-[(2S)-butan-2-yl]-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 3-[(2S)-butan-2-yl]-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide?
The canonical SMILES for 3-[(2S)-butan-2-yl]-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide is CC[C@H](C)c1cc(C(=O)N[C@H]2CCc3nc(C)cn3C2)on1.
What is the InChIKey of 3-[(2S)-butan-2-yl]-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide?
The InChIKey is YDNBOHRFHTWAJB-JQWIXIFHSA-N. The full InChI is InChI=1S/C16H22N4O2/c1-4-10(2)13-7-14(22-19-13)16(21)18-12-5-6-15-17-11(3)8-20(15)9-12/h7-8,10,12H,4-6,9H2,1-3H3,(H,18,21)/t10-,12-/m0/s1.
What are the key properties of 3-[(2S)-butan-2-yl]-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide?
3-[(2S)-butan-2-yl]-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide has a molecular weight of 302.38 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2S)-butan-2-yl]-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 95776370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).