1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide

C14H24N6O — CID 81000899

IUPAC1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide
SMILESCc1c(NN)nc(C(C)(C)C)nc1N1CCCC1C(N)=O
InChIInChI=1S/C14H24N6O/c1-8-11(19-16)17-13(14(2,3)4)18-12(8)20-7-5-6-9(20)10(15)21/h9H,5-7,16H2,1-4H3,(H2,15,21)(H,17,18,19)
InChIKeyWTORURYYADLTCE-UHFFFAOYSA-N
MW292.39 g/mol
LogP0.82
Rot. Bonds3

About 1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide

1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide (PubChem CID 81000899) has the molecular formula C14H24N6O and a molecular weight of 292.39 g/mol. Its IUPAC name is 1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide
PubChem CID81000899
Molecular FormulaC14H24N6O
Molecular Weight292.39 g/mol
Exact Mass292.20
IUPAC Name1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide
SMILESCc1c(NN)nc(C(C)(C)C)nc1N1CCCC1C(N)=O
InChIInChI=1S/C14H24N6O/c1-8-11(19-16)17-13(14(2,3)4)18-12(8)20-7-5-6-9(20)10(15)21/h9H,5-7,16H2,1-4H3,(H2,15,21)(H,17,18,19)
InChIKeyWTORURYYADLTCE-UHFFFAOYSA-N
XLogP0.82
TPSA110.16 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 50.82
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-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidin-2-yl]methanol
CID 80995818
[2-tert-butyl-6-(2-ethylpyrrolidin-1-yl)-5-methylpyrimidin-4-yl]hydrazine
CID 80994714
1-(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)piperidine-2-carboxamide
CID 80994949
(2-tert-butyl-5-methyl-6-piperidin-1-ylpyrimidin-4-yl)hydrazine
CID 81006695
1-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
CID 80994938
[6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-tert-butyl-5-methylpyrimidin-4-yl]hydrazine
CID 115563125
[2-tert-butyl-6-(4-ethylpiperidin-1-yl)-5-methylpyrimidin-4-yl]hydrazine
CID 80995529
1-(6-amino-2,5-dimethylpyrimidin-4-yl)piperidine-2-carboxamide
CID 80806267
1-[2-tert-butyl-6-(methylamino)pyrimidin-4-yl]piperidine-2-carboxamide
CID 80960881
2-tert-butyl-5-methyl-6-(2-methylpyrrolidin-1-yl)-N-propylpyrimidin-4-amine
CID 80987881
1-(6-chloro-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide
CID 63736298
1-(6-amino-2-ethyl-5-methylpyrimidin-4-yl)piperidine-2-carboxamide
CID 80986918

Frequently Asked Questions

What is the IUPAC name of 1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide (CID 81000899) is 1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide is Cc1c(NN)nc(C(C)(C)C)nc1N1CCCC1C(N)=O.
What is the InChIKey of 1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide?
The InChIKey is WTORURYYADLTCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N6O/c1-8-11(19-16)17-13(14(2,3)4)18-12(8)20-7-5-6-9(20)10(15)21/h9H,5-7,16H2,1-4H3,(H2,15,21)(H,17,18,19).
What are the key properties of 1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide?
1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide has a molecular weight of 292.39 g/mol, XLogP of 0.82, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 81000899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).