5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide

C9H16N2O2 — CID 164646306

IUPAC5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide
SMILESCN(O)C(=O)C1CCC(C2CC2)N1
InChIInChI=1S/C9H16N2O2/c1-11(13)9(12)8-5-4-7(10-8)6-2-3-6/h6-8,10,13H,2-5H2,1H3
InChIKeyGMSPQTLXNLPBHM-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.36
Rot. Bonds2

About 5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide

5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide (PubChem CID 164646306) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide
PubChem CID164646306
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide
SMILESCN(O)C(=O)C1CCC(C2CC2)N1
InChIInChI=1S/C9H16N2O2/c1-11(13)9(12)8-5-4-7(10-8)6-2-3-6/h6-8,10,13H,2-5H2,1H3
InChIKeyGMSPQTLXNLPBHM-UHFFFAOYSA-N
XLogP0.36
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide?
The IUPAC name of 5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide (CID 164646306) is 5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for 5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide?
The canonical SMILES for 5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide is CN(O)C(=O)C1CCC(C2CC2)N1.
What is the InChIKey of 5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide?
The InChIKey is GMSPQTLXNLPBHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-11(13)9(12)8-5-4-7(10-8)6-2-3-6/h6-8,10,13H,2-5H2,1H3.
What are the key properties of 5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide?
5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide has a molecular weight of 184.24 g/mol, XLogP of 0.36, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-hydroxy-N-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 164646306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).