4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide

C11H18N4O2 — CID 54869333

IUPAC4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide
SMILESCN(Cc1cnn(C)c1)C(=O)C1CC(O)CN1
InChIInChI=1S/C11H18N4O2/c1-14(6-8-4-13-15(2)7-8)11(17)10-3-9(16)5-12-10/h4,7,9-10,12,16H,3,5-6H2,1-2H3
InChIKeyCMAFUEGZIHCIGB-UHFFFAOYSA-N
MW238.29 g/mol
LogP-0.90
Rot. Bonds3

About 4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide

4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide (PubChem CID 54869333) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide
PubChem CID54869333
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide
SMILESCN(Cc1cnn(C)c1)C(=O)C1CC(O)CN1
InChIInChI=1S/C11H18N4O2/c1-14(6-8-4-13-15(2)7-8)11(17)10-3-9(16)5-12-10/h4,7,9-10,12,16H,3,5-6H2,1-2H3
InChIKeyCMAFUEGZIHCIGB-UHFFFAOYSA-N
XLogP-0.90
TPSA70.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 5-0.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide?
The IUPAC name of 4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide (CID 54869333) is 4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide is CN(Cc1cnn(C)c1)C(=O)C1CC(O)CN1.
What is the InChIKey of 4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide?
The InChIKey is CMAFUEGZIHCIGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-14(6-8-4-13-15(2)7-8)11(17)10-3-9(16)5-12-10/h4,7,9-10,12,16H,3,5-6H2,1-2H3.
What are the key properties of 4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide?
4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide has a molecular weight of 238.29 g/mol, XLogP of -0.90, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 54869333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).