morpholin-2-yl carbamate

C5H10N2O3 — CID 165011060

IUPACmorpholin-2-yl carbamate
SMILESNC(=O)OC1CNCCO1
InChIInChI=1S/C5H10N2O3/c6-5(8)10-4-3-7-1-2-9-4/h4,7H,1-3H2,(H2,6,8)
InChIKeyJSCGJBVNXUBBLK-UHFFFAOYSA-N
MW146.15 g/mol
LogP-0.97
Rot. Bonds1

About morpholin-2-yl carbamate

morpholin-2-yl carbamate (PubChem CID 165011060) has the molecular formula C5H10N2O3 and a molecular weight of 146.15 g/mol. Its IUPAC name is morpholin-2-yl carbamate.

Molecular Properties

Compound Namemorpholin-2-yl carbamate
PubChem CID165011060
Molecular FormulaC5H10N2O3
Molecular Weight146.15 g/mol
Exact Mass146.07
IUPAC Namemorpholin-2-yl carbamate
SMILESNC(=O)OC1CNCCO1
InChIInChI=1S/C5H10N2O3/c6-5(8)10-4-3-7-1-2-9-4/h4,7H,1-3H2,(H2,6,8)
InChIKeyJSCGJBVNXUBBLK-UHFFFAOYSA-N
XLogP-0.97
TPSA73.58 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 ≤ 5-0.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of morpholin-2-yl carbamate?
The IUPAC name of morpholin-2-yl carbamate (CID 165011060) is morpholin-2-yl carbamate.
What is the SMILES notation for morpholin-2-yl carbamate?
The canonical SMILES for morpholin-2-yl carbamate is NC(=O)OC1CNCCO1.
What is the InChIKey of morpholin-2-yl carbamate?
The InChIKey is JSCGJBVNXUBBLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O3/c6-5(8)10-4-3-7-1-2-9-4/h4,7H,1-3H2,(H2,6,8).
What are the key properties of morpholin-2-yl carbamate?
morpholin-2-yl carbamate has a molecular weight of 146.15 g/mol, XLogP of -0.97, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-2-yl carbamate is sourced from PubChem (CID 165011060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).