1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide

C11H18N6O — CID 80937172

IUPAC1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide
SMILESCCc1nc(NN)cc(N2CCCC2C(N)=O)n1
InChIInChI=1S/C11H18N6O/c1-2-8-14-9(16-13)6-10(15-8)17-5-3-4-7(17)11(12)18/h6-7H,2-5,13H2,1H3,(H2,12,18)(H,14,15,16)
InChIKeyUPNWCRIAGAALHH-UHFFFAOYSA-N
MW250.31 g/mol
LogP-0.22
Rot. Bonds4

About 1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide

1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide (PubChem CID 80937172) has the molecular formula C11H18N6O and a molecular weight of 250.31 g/mol. Its IUPAC name is 1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide
PubChem CID80937172
Molecular FormulaC11H18N6O
Molecular Weight250.31 g/mol
Exact Mass250.15
IUPAC Name1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide
SMILESCCc1nc(NN)cc(N2CCCC2C(N)=O)n1
InChIInChI=1S/C11H18N6O/c1-2-8-14-9(16-13)6-10(15-8)17-5-3-4-7(17)11(12)18/h6-7H,2-5,13H2,1H3,(H2,12,18)(H,14,15,16)
InChIKeyUPNWCRIAGAALHH-UHFFFAOYSA-N
XLogP-0.22
TPSA110.16 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide (CID 80937172) is 1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide is CCc1nc(NN)cc(N2CCCC2C(N)=O)n1.
What is the InChIKey of 1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide?
The InChIKey is UPNWCRIAGAALHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N6O/c1-2-8-14-9(16-13)6-10(15-8)17-5-3-4-7(17)11(12)18/h6-7H,2-5,13H2,1H3,(H2,12,18)(H,14,15,16).
What are the key properties of 1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide?
1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide has a molecular weight of 250.31 g/mol, XLogP of -0.22, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethyl-6-hydrazinylpyrimidin-4-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 80937172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).