(4-aminooxolan-3-yl) carbamate

C5H10N2O3 — CID 90426775

IUPAC(4-aminooxolan-3-yl) carbamate
SMILESNC(=O)OC1COCC1N
InChIInChI=1S/C5H10N2O3/c6-3-1-9-2-4(3)10-5(7)8/h3-4H,1-2,6H2,(H2,7,8)
InChIKeyQDJZBIPVDOLOBX-UHFFFAOYSA-N
MW146.15 g/mol
LogP-1.19
Rot. Bonds1

About (4-aminooxolan-3-yl) carbamate

(4-aminooxolan-3-yl) carbamate (PubChem CID 90426775) has the molecular formula C5H10N2O3 and a molecular weight of 146.15 g/mol. Its IUPAC name is (4-aminooxolan-3-yl) carbamate.

Molecular Properties

Compound Name(4-aminooxolan-3-yl) carbamate
PubChem CID90426775
Molecular FormulaC5H10N2O3
Molecular Weight146.15 g/mol
Exact Mass146.07
IUPAC Name(4-aminooxolan-3-yl) carbamate
SMILESNC(=O)OC1COCC1N
InChIInChI=1S/C5H10N2O3/c6-3-1-9-2-4(3)10-5(7)8/h3-4H,1-2,6H2,(H2,7,8)
InChIKeyQDJZBIPVDOLOBX-UHFFFAOYSA-N
XLogP-1.19
TPSA87.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 5-1.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-aminooxolan-3-yl) carbamate?
The IUPAC name of (4-aminooxolan-3-yl) carbamate (CID 90426775) is (4-aminooxolan-3-yl) carbamate.
What is the SMILES notation for (4-aminooxolan-3-yl) carbamate?
The canonical SMILES for (4-aminooxolan-3-yl) carbamate is NC(=O)OC1COCC1N.
What is the InChIKey of (4-aminooxolan-3-yl) carbamate?
The InChIKey is QDJZBIPVDOLOBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O3/c6-3-1-9-2-4(3)10-5(7)8/h3-4H,1-2,6H2,(H2,7,8).
What are the key properties of (4-aminooxolan-3-yl) carbamate?
(4-aminooxolan-3-yl) carbamate has a molecular weight of 146.15 g/mol, XLogP of -1.19, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminooxolan-3-yl) carbamate is sourced from PubChem (CID 90426775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).