4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one

C8H15N3O2 — CID 130949351

IUPAC4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one
SMILESO=C1NOCC1NC1CCNCC1
InChIInChI=1S/C8H15N3O2/c12-8-7(5-13-11-8)10-6-1-3-9-4-2-6/h6-7,9-10H,1-5H2,(H,11,12)
InChIKeyWTMUETPILNJPSN-UHFFFAOYSA-N
MW185.23 g/mol
LogP-1.24
Rot. Bonds2

About 4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one

4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one (PubChem CID 130949351) has the molecular formula C8H15N3O2 and a molecular weight of 185.23 g/mol. Its IUPAC name is 4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one.

Molecular Properties

Compound Name4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one
PubChem CID130949351
Molecular FormulaC8H15N3O2
Molecular Weight185.23 g/mol
Exact Mass185.12
IUPAC Name4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one
SMILESO=C1NOCC1NC1CCNCC1
InChIInChI=1S/C8H15N3O2/c12-8-7(5-13-11-8)10-6-1-3-9-4-2-6/h6-7,9-10H,1-5H2,(H,11,12)
InChIKeyWTMUETPILNJPSN-UHFFFAOYSA-N
XLogP-1.24
TPSA62.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 5-1.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one?
The IUPAC name of 4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one (CID 130949351) is 4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one.
What is the SMILES notation for 4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one?
The canonical SMILES for 4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one is O=C1NOCC1NC1CCNCC1.
What is the InChIKey of 4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one?
The InChIKey is WTMUETPILNJPSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2/c12-8-7(5-13-11-8)10-6-1-3-9-4-2-6/h6-7,9-10H,1-5H2,(H,11,12).
What are the key properties of 4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one?
4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one has a molecular weight of 185.23 g/mol, XLogP of -1.24, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(piperidin-4-ylamino)-1,2-oxazolidin-3-one is sourced from PubChem (CID 130949351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).