N-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide

C15H21N3O3 — CID 46446266

IUPACN-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide
SMILESCc1noc(C)c1C(=O)N1CCC(NC(=O)C2CC2)CC1
InChIInChI=1S/C15H21N3O3/c1-9-13(10(2)21-17-9)15(20)18-7-5-12(6-8-18)16-14(19)11-3-4-11/h11-12H,3-8H2,1-2H3,(H,16,19)
InChIKeyXEXDDRUFWGNLHE-UHFFFAOYSA-N
MW291.35 g/mol
LogP1.42
Rot. Bonds3

About N-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide

N-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide (PubChem CID 46446266) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is N-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide
PubChem CID46446266
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC NameN-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide
SMILESCc1noc(C)c1C(=O)N1CCC(NC(=O)C2CC2)CC1
InChIInChI=1S/C15H21N3O3/c1-9-13(10(2)21-17-9)15(20)18-7-5-12(6-8-18)16-14(19)11-3-4-11/h11-12H,3-8H2,1-2H3,(H,16,19)
InChIKeyXEXDDRUFWGNLHE-UHFFFAOYSA-N
XLogP1.42
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide?
The IUPAC name of N-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide (CID 46446266) is N-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide is Cc1noc(C)c1C(=O)N1CCC(NC(=O)C2CC2)CC1.
What is the InChIKey of N-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide?
The InChIKey is XEXDDRUFWGNLHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-9-13(10(2)21-17-9)15(20)18-7-5-12(6-8-18)16-14(19)11-3-4-11/h11-12H,3-8H2,1-2H3,(H,16,19).
What are the key properties of N-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide?
N-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide has a molecular weight of 291.35 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]cyclopropanecarboxamide is sourced from PubChem (CID 46446266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).