N-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide

C10H18N6O — CID 115357503

IUPACN-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide
SMILESCC(C)(C)NC(=O)CNc1ccnc(NN)n1
InChIInChI=1S/C10H18N6O/c1-10(2,3)15-8(17)6-13-7-4-5-12-9(14-7)16-11/h4-5H,6,11H2,1-3H3,(H,15,17)(H2,12,13,14,16)
InChIKeyRMNAPWWMLQOZJO-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.09
Rot. Bonds4

About N-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide

N-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide (PubChem CID 115357503) has the molecular formula C10H18N6O and a molecular weight of 238.29 g/mol. Its IUPAC name is N-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide
PubChem CID115357503
Molecular FormulaC10H18N6O
Molecular Weight238.29 g/mol
Exact Mass238.15
IUPAC NameN-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide
SMILESCC(C)(C)NC(=O)CNc1ccnc(NN)n1
InChIInChI=1S/C10H18N6O/c1-10(2,3)15-8(17)6-13-7-4-5-12-9(14-7)16-11/h4-5H,6,11H2,1-3H3,(H,15,17)(H2,12,13,14,16)
InChIKeyRMNAPWWMLQOZJO-UHFFFAOYSA-N
XLogP0.09
TPSA104.96 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.09
H-Bond Donors ≤ 54
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 N-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide?
The IUPAC name of N-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide (CID 115357503) is N-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide.
What is the SMILES notation for N-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide?
The canonical SMILES for N-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide is CC(C)(C)NC(=O)CNc1ccnc(NN)n1.
What is the InChIKey of N-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide?
The InChIKey is RMNAPWWMLQOZJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N6O/c1-10(2,3)15-8(17)6-13-7-4-5-12-9(14-7)16-11/h4-5H,6,11H2,1-3H3,(H,15,17)(H2,12,13,14,16).
What are the key properties of N-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide?
N-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide has a molecular weight of 238.29 g/mol, XLogP of 0.09, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide is sourced from PubChem (CID 115357503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).