N-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine

C11H21N5O — CID 114944783

IUPACN-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine
SMILESCCOC(C)(C)CNc1cc(NN)nc(C)n1
InChIInChI=1S/C11H21N5O/c1-5-17-11(3,4)7-13-9-6-10(16-12)15-8(2)14-9/h6H,5,7,12H2,1-4H3,(H2,13,14,15,16)
InChIKeySJONBVBLJZUHTN-UHFFFAOYSA-N
MW239.32 g/mol
LogP1.30
Rot. Bonds6

About N-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine

N-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine (PubChem CID 114944783) has the molecular formula C11H21N5O and a molecular weight of 239.32 g/mol. Its IUPAC name is N-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine
PubChem CID114944783
Molecular FormulaC11H21N5O
Molecular Weight239.32 g/mol
Exact Mass239.17
IUPAC NameN-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine
SMILESCCOC(C)(C)CNc1cc(NN)nc(C)n1
InChIInChI=1S/C11H21N5O/c1-5-17-11(3,4)7-13-9-6-10(16-12)15-8(2)14-9/h6H,5,7,12H2,1-4H3,(H2,13,14,15,16)
InChIKeySJONBVBLJZUHTN-UHFFFAOYSA-N
XLogP1.30
TPSA85.09 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 51.30
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

N-(2-ethoxy-2-methylpropyl)-6-methoxy-2-methylpyrimidin-4-amine
CID 114942912
ethyl 3-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]propanoate
CID 80908084
6-hydrazinyl-2-methyl-N-(2-methyl-2-methylsulfonylpropyl)pyrimidin-4-amine
CID 80928670
6-hydrazinyl-2-methyl-N-(2-methylbutan-2-yl)pyrimidin-4-amine
CID 80921159
6-hydrazinyl-2-methyl-N-pentylpyrimidin-4-amine
CID 80932312
6-hydrazinyl-N-(2-methoxyethyl)-2-methylpyrimidin-4-amine
CID 80932180
N-(3-ethylpentan-3-yl)-6-hydrazinyl-2-methylpyrimidin-4-amine
CID 80915524
6-hydrazinyl-2-(methoxymethyl)-N-(2-methoxy-2-methylpropyl)pyrimidin-4-amine
CID 104767519
6-hydrazinyl-N-(2-methoxypropyl)-2-methylpyrimidin-4-amine
CID 102701972
6-hydrazinyl-2-methyl-N-(3-methylbutyl)pyrimidin-4-amine
CID 80932318
2-tert-butyl-N-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-5-methylpyrimidin-4-amine
CID 114944808
N-ethyl-2-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]acetamide
CID 80907084

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine?
The IUPAC name of N-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine (CID 114944783) is N-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine.
What is the SMILES notation for N-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine?
The canonical SMILES for N-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine is CCOC(C)(C)CNc1cc(NN)nc(C)n1.
What is the InChIKey of N-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine?
The InChIKey is SJONBVBLJZUHTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O/c1-5-17-11(3,4)7-13-9-6-10(16-12)15-8(2)14-9/h6H,5,7,12H2,1-4H3,(H2,13,14,15,16).
What are the key properties of N-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine?
N-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine has a molecular weight of 239.32 g/mol, XLogP of 1.30, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-2-methylpropyl)-6-hydrazinyl-2-methylpyrimidin-4-amine is sourced from PubChem (CID 114944783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).