N-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide

C17H23N3O3 — CID 86950757

IUPACN-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide
SMILESCC(C)(C)N1CCC(NC(=O)c2ncoc2-c2ccco2)CC1
InChIInChI=1S/C17H23N3O3/c1-17(2,3)20-8-6-12(7-9-20)19-16(21)14-15(23-11-18-14)13-5-4-10-22-13/h4-5,10-12H,6-9H2,1-3H3,(H,19,21)
InChIKeyPQNQGKNJDVHGIM-UHFFFAOYSA-N
MW317.39 g/mol
LogP2.93
Rot. Bonds3

About N-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide

N-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide (PubChem CID 86950757) has the molecular formula C17H23N3O3 and a molecular weight of 317.39 g/mol. Its IUPAC name is N-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide
PubChem CID86950757
Molecular FormulaC17H23N3O3
Molecular Weight317.39 g/mol
Exact Mass317.17
IUPAC NameN-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide
SMILESCC(C)(C)N1CCC(NC(=O)c2ncoc2-c2ccco2)CC1
InChIInChI=1S/C17H23N3O3/c1-17(2,3)20-8-6-12(7-9-20)19-16(21)14-15(23-11-18-14)13-5-4-10-22-13/h4-5,10-12H,6-9H2,1-3H3,(H,19,21)
InChIKeyPQNQGKNJDVHGIM-UHFFFAOYSA-N
XLogP2.93
TPSA71.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-yl]-5-(furan-2-yl)-1,3-oxazole-4-carboxamide
CID 86963309
N-(1-tert-butylpiperidin-4-yl)benzamide
CID 61036493
2-[[5-(furan-2-yl)-1,3-oxazole-4-carbonyl]amino]ethylcarbamic acid
CID 19768758
N-(1-tert-butylpiperidin-4-yl)-4-(2,2-dimethylpropanoyl)benzamide
CID 170668441
2-bromo-N-(1-tert-butylpiperidin-4-yl)pyridine-3-carboxamide
CID 103754728
5-(furan-2-yl)-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-1,3-oxazole-4-carboxamide
CID 86950756
[5-(furan-2-yl)-1,3-oxazol-4-yl]-[4-(2-methoxyethyl)piperazin-1-yl]methanone
CID 86950986
N-[(3R)-1-tert-butylpyrrolidin-3-yl]benzamide
CID 155637447
N-cyclopropyl-5-(4-fluorophenyl)-1,3-oxazole-4-carboxamide
CID 73440583
3-amino-N-(1-tert-butylpiperidin-4-yl)-2-methylbenzamide
CID 61101990
5-bromo-N-(1-tert-butylpiperidin-4-yl)pyridine-2-carboxamide
CID 62953534
N-[(2R)-2-cyano-4-phenylbutan-2-yl]-5-(furan-2-yl)-1,3-oxazole-4-carboxamide
CID 97238400

Frequently Asked Questions

What is the IUPAC name of N-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide (CID 86950757) is N-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide is CC(C)(C)N1CCC(NC(=O)c2ncoc2-c2ccco2)CC1.
What is the InChIKey of N-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide?
The InChIKey is PQNQGKNJDVHGIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O3/c1-17(2,3)20-8-6-12(7-9-20)19-16(21)14-15(23-11-18-14)13-5-4-10-22-13/h4-5,10-12H,6-9H2,1-3H3,(H,19,21).
What are the key properties of N-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide?
N-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide has a molecular weight of 317.39 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-tert-butylpiperidin-4-yl)-5-(furan-2-yl)-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 86950757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).