2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide

C18H30N4O2 — CID 51102021

IUPAC2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
SMILESCC(C)c1cc(NC(=O)CN2CCC(N3CCCCC3)CC2)on1
InChIInChI=1S/C18H30N4O2/c1-14(2)16-12-18(24-20-16)19-17(23)13-21-10-6-15(7-11-21)22-8-4-3-5-9-22/h12,14-15H,3-11,13H2,1-2H3,(H,19,23)
InChIKeyZYPHRWZKNMXSNQ-UHFFFAOYSA-N
MW334.46 g/mol
LogP2.69
Rot. Bonds5

About 2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide

2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide (PubChem CID 51102021) has the molecular formula C18H30N4O2 and a molecular weight of 334.46 g/mol. Its IUPAC name is 2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
PubChem CID51102021
Molecular FormulaC18H30N4O2
Molecular Weight334.46 g/mol
Exact Mass334.24
IUPAC Name2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
SMILESCC(C)c1cc(NC(=O)CN2CCC(N3CCCCC3)CC2)on1
InChIInChI=1S/C18H30N4O2/c1-14(2)16-12-18(24-20-16)19-17(23)13-21-10-6-15(7-11-21)22-8-4-3-5-9-22/h12,14-15H,3-11,13H2,1-2H3,(H,19,23)
InChIKeyZYPHRWZKNMXSNQ-UHFFFAOYSA-N
XLogP2.69
TPSA61.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.46
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide?
The IUPAC name of 2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide (CID 51102021) is 2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide.
What is the SMILES notation for 2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide?
The canonical SMILES for 2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide is CC(C)c1cc(NC(=O)CN2CCC(N3CCCCC3)CC2)on1.
What is the InChIKey of 2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide?
The InChIKey is ZYPHRWZKNMXSNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N4O2/c1-14(2)16-12-18(24-20-16)19-17(23)13-21-10-6-15(7-11-21)22-8-4-3-5-9-22/h12,14-15H,3-11,13H2,1-2H3,(H,19,23).
What are the key properties of 2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide?
2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide has a molecular weight of 334.46 g/mol, XLogP of 2.69, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-piperidin-1-ylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide is sourced from PubChem (CID 51102021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).