3-Carbamoyl-2,2,5,5-tetramethyl-3-pyrrolin-1-yloxy

C9H15N2O2 — CID 592762

IUPAC—
SMILESCC1(C)C=C(C(N)=O)C(C)(C)N1[O]
InChIInChI=1S/C9H15N2O2/c1-8(2)5-6(7(10)12)9(3,4)11(8)13/h5H,1-4H3,(H2,10,12)
InChIKeyRUEXQFPLRRIFTI-UHFFFAOYSA-N
MW183.23 g/mol
LogP0.62
Rot. Bonds1

About 3-Carbamoyl-2,2,5,5-tetramethyl-3-pyrrolin-1-yloxy

3-Carbamoyl-2,2,5,5-tetramethyl-3-pyrrolin-1-yloxy (PubChem CID 592762) has the molecular formula C9H15N2O2 and a molecular weight of 183.23 g/mol.

Molecular Properties

Compound Name3-Carbamoyl-2,2,5,5-tetramethyl-3-pyrrolin-1-yloxy
PubChem CID592762
Molecular FormulaC9H15N2O2
Molecular Weight183.23 g/mol
Exact Mass183.11
IUPAC Name—
SMILESCC1(C)C=C(C(N)=O)C(C)(C)N1[O]
InChIInChI=1S/C9H15N2O2/c1-8(2)5-6(7(10)12)9(3,4)11(8)13/h5H,1-4H3,(H2,10,12)
InChIKeyRUEXQFPLRRIFTI-UHFFFAOYSA-N
XLogP0.62
TPSA66.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.23
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-Carbamoyl-2,2,5,5-tetramethyl-3-pyrrolin-1-yloxy?
The IUPAC name of 3-Carbamoyl-2,2,5,5-tetramethyl-3-pyrrolin-1-yloxy (CID 592762) is not available.
What is the SMILES notation for 3-Carbamoyl-2,2,5,5-tetramethyl-3-pyrrolin-1-yloxy?
The canonical SMILES for 3-Carbamoyl-2,2,5,5-tetramethyl-3-pyrrolin-1-yloxy is CC1(C)C=C(C(N)=O)C(C)(C)N1[O].
What is the InChIKey of 3-Carbamoyl-2,2,5,5-tetramethyl-3-pyrrolin-1-yloxy?
The InChIKey is RUEXQFPLRRIFTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N2O2/c1-8(2)5-6(7(10)12)9(3,4)11(8)13/h5H,1-4H3,(H2,10,12).
What are the key properties of 3-Carbamoyl-2,2,5,5-tetramethyl-3-pyrrolin-1-yloxy?
3-Carbamoyl-2,2,5,5-tetramethyl-3-pyrrolin-1-yloxy has a molecular weight of 183.23 g/mol, XLogP of 0.62, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-Carbamoyl-2,2,5,5-tetramethyl-3-pyrrolin-1-yloxy is sourced from PubChem (CID 592762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).