[1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone

C15H21N3O3 — CID 70758906

IUPAC[1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone
SMILESCc1ocnc1C(=O)N1CCC(C(=O)N2CCCC2)CC1
InChIInChI=1S/C15H21N3O3/c1-11-13(16-10-21-11)15(20)18-8-4-12(5-9-18)14(19)17-6-2-3-7-17/h10,12H,2-9H2,1H3
InChIKeyLUHHSIMDXJZZMJ-UHFFFAOYSA-N
MW291.35 g/mol
LogP1.46
Rot. Bonds2

About [1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone

[1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone (PubChem CID 70758906) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is [1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone
PubChem CID70758906
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name[1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone
SMILESCc1ocnc1C(=O)N1CCC(C(=O)N2CCCC2)CC1
InChIInChI=1S/C15H21N3O3/c1-11-13(16-10-21-11)15(20)18-8-4-12(5-9-18)14(19)17-6-2-3-7-17/h10,12H,2-9H2,1H3
InChIKeyLUHHSIMDXJZZMJ-UHFFFAOYSA-N
XLogP1.46
TPSA66.65 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone (CID 70758906) is [1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone is Cc1ocnc1C(=O)N1CCC(C(=O)N2CCCC2)CC1.
What is the InChIKey of [1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone?
The InChIKey is LUHHSIMDXJZZMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-11-13(16-10-21-11)15(20)18-8-4-12(5-9-18)14(19)17-6-2-3-7-17/h10,12H,2-9H2,1H3.
What are the key properties of [1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone?
[1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone has a molecular weight of 291.35 g/mol, XLogP of 1.46, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-methyl-1,3-oxazole-4-carbonyl)piperidin-4-yl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 70758906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).