6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine

C7H14N6O — CID 19150351

IUPAC6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine
SMILESCOCCNc1ncnc(NN)c1N
InChIInChI=1S/C7H14N6O/c1-14-3-2-10-6-5(8)7(13-9)12-4-11-6/h4H,2-3,8-9H2,1H3,(H2,10,11,12,13)
InChIKeyFACTVIRUWKCAGM-UHFFFAOYSA-N
MW198.23 g/mol
LogP-0.60
Rot. Bonds5

About 6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine

6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine (PubChem CID 19150351) has the molecular formula C7H14N6O and a molecular weight of 198.23 g/mol. Its IUPAC name is 6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine.

Molecular Properties

Compound Name6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine
PubChem CID19150351
Molecular FormulaC7H14N6O
Molecular Weight198.23 g/mol
Exact Mass198.12
IUPAC Name6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine
SMILESCOCCNc1ncnc(NN)c1N
InChIInChI=1S/C7H14N6O/c1-14-3-2-10-6-5(8)7(13-9)12-4-11-6/h4H,2-3,8-9H2,1H3,(H2,10,11,12,13)
InChIKeyFACTVIRUWKCAGM-UHFFFAOYSA-N
XLogP-0.60
TPSA111.11 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 5-0.60
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-N-(2-methoxyethyl)-6-N-methylpyrimidine-4,5,6-triamine
CID 19135072
4-N-cyclohexyl-6-N-(2-methoxyethyl)pyrimidine-4,5,6-triamine
CID 19135849
4-N-hexadecyl-6-hydrazinylpyrimidine-4,5-diamine
CID 19142423
4-N-(2-methoxyethyl)-5-propylpyrimidine-4,6-diamine
CID 80765819
4-N-[(2-chlorophenyl)methyl]-6-N-(2-methoxyethyl)pyrimidine-4,5,6-triamine
CID 19150506
6-N-(2-methoxyethyl)-4-N-(2-methoxyphenyl)pyrimidine-4,5,6-triamine
CID 19148143
4-N-(2-methoxyethyl)-6-N-(2-thiophen-2-ylethyl)pyrimidine-4,5,6-triamine
CID 19150523
6-N-(2-methoxyethyl)-4-N-(pyridin-3-ylmethyl)pyrimidine-4,5,6-triamine
CID 22542825
3-[[5-amino-6-(2-methoxyethylamino)pyrimidin-4-yl]-(2-cyanoethyl)amino]propanenitrile
CID 19141479
4-N-(5-chloro-2-methylphenyl)-6-N-(2-methoxyethyl)pyrimidine-4,5,6-triamine
CID 22547276
4-N-(2-methoxyethyl)-6-(4-phenylpiperazin-1-yl)pyrimidine-4,5-diamine
CID 19138606
N'-[5-amino-6-(2-methoxyethylamino)pyrimidin-4-yl]-4-fluorobenzohydrazide
CID 19150448

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine?
The IUPAC name of 6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine (CID 19150351) is 6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine.
What is the SMILES notation for 6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine?
The canonical SMILES for 6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine is COCCNc1ncnc(NN)c1N.
What is the InChIKey of 6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine?
The InChIKey is FACTVIRUWKCAGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N6O/c1-14-3-2-10-6-5(8)7(13-9)12-4-11-6/h4H,2-3,8-9H2,1H3,(H2,10,11,12,13).
What are the key properties of 6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine?
6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine has a molecular weight of 198.23 g/mol, XLogP of -0.60, 5 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-4-N-(2-methoxyethyl)pyrimidine-4,5-diamine is sourced from PubChem (CID 19150351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).