N,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide

C18H24N4O2 — CID 125003122

IUPACN,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide
SMILESCc1cccc(N2CCC[C@H](N(C)C(=O)c3c(C)noc3C)C2)n1
InChIInChI=1S/C18H24N4O2/c1-12-7-5-9-16(19-12)22-10-6-8-15(11-22)21(4)18(23)17-13(2)20-24-14(17)3/h5,7,9,15H,6,8,10-11H2,1-4H3/t15-/m0/s1
InChIKeySPICYBMKUOYTGX-HNNXBMFYSA-N
MW328.42 g/mol
LogP2.74
Rot. Bonds3

About N,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide

N,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide (PubChem CID 125003122) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is N,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound NameN,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide
PubChem CID125003122
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC NameN,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide
SMILESCc1cccc(N2CCC[C@H](N(C)C(=O)c3c(C)noc3C)C2)n1
InChIInChI=1S/C18H24N4O2/c1-12-7-5-9-16(19-12)22-10-6-8-15(11-22)21(4)18(23)17-13(2)20-24-14(17)3/h5,7,9,15H,6,8,10-11H2,1-4H3/t15-/m0/s1
InChIKeySPICYBMKUOYTGX-HNNXBMFYSA-N
XLogP2.74
TPSA62.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide with MolForge

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Related Compounds

3-ethyl-N,5-dimethyl-N-[(3S)-1-pyridin-2-ylpiperidin-3-yl]-1,2-oxazole-4-carboxamide
CID 125005100
N,6-dimethyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-2-carboxamide
CID 124981919
2-methoxy-N-methyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyridine-3-carboxamide
CID 125014728
2-methoxy-N-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyridine-3-carboxamide
CID 125014729
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide
CID 124985226
N-methyl-2-(2-methylimidazol-1-yl)-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide
CID 124982829
N-methyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]pyrrolidine-1-sulfonamide
CID 124974868
3-(1,5-dimethylpyrazol-4-yl)-N-methyl-N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]propanamide
CID 124947513
N,2-dimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-[(2-phenoxyacetyl)amino]propanamide
CID 124940226
3-[2-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-1-methyl-1-(1-pyridazin-3-ylpiperidin-3-yl)urea
CID 136517389
N-[1-(6-cyano-2-pyridinyl)piperidin-3-yl]-N-methylcyclopropanecarboxamide
CID 166605930
N-[(3R)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]acetamide
CID 124519191

Frequently Asked Questions

What is the IUPAC name of N,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide?
The IUPAC name of N,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide (CID 125003122) is N,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide.
What is the SMILES notation for N,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide?
The canonical SMILES for N,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide is Cc1cccc(N2CCC[C@H](N(C)C(=O)c3c(C)noc3C)C2)n1.
What is the InChIKey of N,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide?
The InChIKey is SPICYBMKUOYTGX-HNNXBMFYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-12-7-5-9-16(19-12)22-10-6-8-15(11-22)21(4)18(23)17-13(2)20-24-14(17)3/h5,7,9,15H,6,8,10-11H2,1-4H3/t15-/m0/s1.
What are the key properties of N,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide?
N,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide has a molecular weight of 328.42 g/mol, XLogP of 2.74, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,3,5-trimethyl-N-[(3S)-1-(6-methyl-2-pyridinyl)piperidin-3-yl]-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 125003122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).