6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine

C14H19N5O — CID 80900531

IUPAC6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine
SMILESCc1nc(NN)c(C)c(NCCOc2ccccc2)n1
InChIInChI=1S/C14H19N5O/c1-10-13(17-11(2)18-14(10)19-15)16-8-9-20-12-6-4-3-5-7-12/h3-7H,8-9,15H2,1-2H3,(H2,16,17,18,19)
InChIKeyCOTGLLVHOLJRHM-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.87
Rot. Bonds6

About 6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine

6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine (PubChem CID 80900531) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is 6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine
PubChem CID80900531
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine
SMILESCc1nc(NN)c(C)c(NCCOc2ccccc2)n1
InChIInChI=1S/C14H19N5O/c1-10-13(17-11(2)18-14(10)19-15)16-8-9-20-12-6-4-3-5-7-12/h3-7H,8-9,15H2,1-2H3,(H2,16,17,18,19)
InChIKeyCOTGLLVHOLJRHM-UHFFFAOYSA-N
XLogP1.87
TPSA85.09 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.87
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

3,5-dichloro-6-hydrazinyl-N-(2-phenoxyethyl)pyridin-2-amine
CID 102761875
5-methyl-4-N-(2-phenoxyethyl)-2-propan-2-ylpyrimidine-4,6-diamine
CID 80983631
6-hydrazinyl-N-(2-phenoxyethyl)-5-propan-2-ylpyrimidin-4-amine
CID 80902452
6-chloro-2-ethyl-5-methyl-N-(2-phenoxyethyl)pyrimidin-4-amine
CID 79238156
5-methyl-2-phenoxy-N-(2-phenoxyethyl)pyrimidin-4-amine
CID 117085027
6-chloro-4,5-dimethyl-N-(2-phenoxyethyl)pyridazin-3-amine
CID 63271688
2-[2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]ethoxy]acetamide
CID 106242021
6-methyl-2-N-(3-phenoxypropyl)pyridine-2,3-diamine
CID 81131859
(2,5-dimethyl-6-phenylmethoxypyrimidin-4-yl)hydrazine
CID 80910056
2-N,5-dimethyl-4-N-(2-phenoxyethyl)pyrimidine-2,4-diamine
CID 80814813
4-N-(2-phenoxyethyl)quinazoline-2,4-diamine
CID 80791774
2,5-dimethyl-6-phenoxy-N-propylpyrimidin-4-amine
CID 80870307

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine (CID 80900531) is 6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine is Cc1nc(NN)c(C)c(NCCOc2ccccc2)n1.
What is the InChIKey of 6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine?
The InChIKey is COTGLLVHOLJRHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-10-13(17-11(2)18-14(10)19-15)16-8-9-20-12-6-4-3-5-7-12/h3-7H,8-9,15H2,1-2H3,(H2,16,17,18,19).
What are the key properties of 6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine?
6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine has a molecular weight of 273.34 g/mol, XLogP of 1.87, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-2,5-dimethyl-N-(2-phenoxyethyl)pyrimidin-4-amine is sourced from PubChem (CID 80900531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).