1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide

C10H16N6O — CID 80904751

IUPAC1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1c1ccnc(NN)n1
InChIInChI=1S/C10H16N6O/c1-12-9(17)7-3-2-6-16(7)8-4-5-13-10(14-8)15-11/h4-5,7H,2-3,6,11H2,1H3,(H,12,17)(H,13,14,15)
InChIKeyOUDUCOSQGANGRE-UHFFFAOYSA-N
MW236.28 g/mol
LogP-0.52
Rot. Bonds3

About 1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide

1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide (PubChem CID 80904751) has the molecular formula C10H16N6O and a molecular weight of 236.28 g/mol. Its IUPAC name is 1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
PubChem CID80904751
Molecular FormulaC10H16N6O
Molecular Weight236.28 g/mol
Exact Mass236.14
IUPAC Name1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1c1ccnc(NN)n1
InChIInChI=1S/C10H16N6O/c1-12-9(17)7-3-2-6-16(7)8-4-5-13-10(14-8)15-11/h4-5,7H,2-3,6,11H2,1H3,(H,12,17)(H,13,14,15)
InChIKeyOUDUCOSQGANGRE-UHFFFAOYSA-N
XLogP-0.52
TPSA96.17 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.28
LogP ≤ 5-0.52
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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Related Compounds

1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
CID 80905623
1-(5-chloro-2-hydrazinylpyrimidin-4-yl)-N-methylpiperidine-2-carboxamide
CID 80904855
[4-(2-propan-2-ylpyrrolidin-1-yl)pyrimidin-2-yl]hydrazine
CID 80924533
1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide
CID 104540139
1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide
CID 103000781
1-[2-amino-6-(methylamino)pyrimidin-4-yl]-N-methylpyrrolidine-2-carboxamide
CID 80806770
1-(6-chloro-2-pyridinyl)-N-methylpiperidine-2-carboxamide
CID 63585985
1-(5-aminopyrazin-2-yl)-N-methylpiperidine-2-carboxamide
CID 80653622
1-(6-fluoropyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
CID 115416730
(2R)-1-(2-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid
CID 94586856
(2S)-1-(2-methylpyrimidin-4-yl)pyrrolidine-2-carboxylic acid
CID 94586857
1-(6-hydrazinyl-3-nitro-2-pyridinyl)-N-methylpyrrolidine-2-carboxamide
CID 80905319

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide?
The IUPAC name of 1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide (CID 80904751) is 1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide is CNC(=O)C1CCCN1c1ccnc(NN)n1.
What is the InChIKey of 1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide?
The InChIKey is OUDUCOSQGANGRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N6O/c1-12-9(17)7-3-2-6-16(7)8-4-5-13-10(14-8)15-11/h4-5,7H,2-3,6,11H2,1H3,(H,12,17)(H,13,14,15).
What are the key properties of 1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide?
1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide has a molecular weight of 236.28 g/mol, XLogP of -0.52, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 80904751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).