N-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine

C14H19N5O — CID 115916133

IUPACN-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine
SMILESCCOCCNc1cc(NN)nc(-c2ccccc2)n1
InChIInChI=1S/C14H19N5O/c1-2-20-9-8-16-12-10-13(19-15)18-14(17-12)11-6-4-3-5-7-11/h3-7,10H,2,8-9,15H2,1H3,(H2,16,17,18,19)
InChIKeyTUWVMSJBEMDBAZ-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.88
Rot. Bonds7

About N-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine

N-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine (PubChem CID 115916133) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine
PubChem CID115916133
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC NameN-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine
SMILESCCOCCNc1cc(NN)nc(-c2ccccc2)n1
InChIInChI=1S/C14H19N5O/c1-2-20-9-8-16-12-10-13(19-15)18-14(17-12)11-6-4-3-5-7-11/h3-7,10H,2,8-9,15H2,1H3,(H2,16,17,18,19)
InChIKeyTUWVMSJBEMDBAZ-UHFFFAOYSA-N
XLogP1.88
TPSA85.09 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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

6-hydrazinyl-N-(2-methoxyethyl)-2-phenylpyrimidin-4-amine
CID 112559970
2-[2-[(6-hydrazinyl-2-phenylpyrimidin-4-yl)amino]ethoxy]ethanol
CID 115916179
[6-(2-ethoxyethoxy)-2-phenylpyrimidin-4-yl]hydrazine
CID 115916297
2-[(6-hydrazinyl-2-phenylpyrimidin-4-yl)amino]ethanol
CID 112559967
6-hydrazinyl-N-(4-methylpentyl)-2-phenylpyrimidin-4-amine
CID 115916187
N-(2,2-dimethylpropyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine
CID 113353653
[2-phenyl-6-(2-propoxyethoxy)pyrimidin-4-yl]hydrazine
CID 115916312
(6-ethyl-2-phenylpyrimidin-4-yl)hydrazine
CID 62252566
6-hydrazinyl-N-(3-methylpentan-2-yl)-2-phenylpyrimidin-4-amine
CID 115916157
6-chloro-N-[2-(2-methoxyethoxy)ethyl]-2-phenylpyrimidin-4-amine
CID 115914756
(2-phenyl-6-propylpyrimidin-4-yl)hydrazine
CID 62252370
4-N-pentyl-2-phenyl-6-N-propylpyrimidine-4,6-diamine
CID 112879234

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine?
The IUPAC name of N-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine (CID 115916133) is N-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine.
What is the SMILES notation for N-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine?
The canonical SMILES for N-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine is CCOCCNc1cc(NN)nc(-c2ccccc2)n1.
What is the InChIKey of N-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine?
The InChIKey is TUWVMSJBEMDBAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-2-20-9-8-16-12-10-13(19-15)18-14(17-12)11-6-4-3-5-7-11/h3-7,10H,2,8-9,15H2,1H3,(H2,16,17,18,19).
What are the key properties of N-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine?
N-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine has a molecular weight of 273.34 g/mol, XLogP of 1.88, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-6-hydrazinyl-2-phenylpyrimidin-4-amine is sourced from PubChem (CID 115916133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).