6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine

C15H21N5O — CID 80924119

IUPAC6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine
SMILESCOc1ccc(C(C)Nc2nc(C)nc(NN)c2C)cc1
InChIInChI=1S/C15H21N5O/c1-9-14(18-11(3)19-15(9)20-16)17-10(2)12-5-7-13(21-4)8-6-12/h5-8,10H,16H2,1-4H3,(H2,17,18,19,20)
InChIKeyZPALCJWVTDHLDW-UHFFFAOYSA-N
MW287.37 g/mol
LogP2.56
Rot. Bonds5

About 6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine

6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine (PubChem CID 80924119) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine
PubChem CID80924119
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine
SMILESCOc1ccc(C(C)Nc2nc(C)nc(NN)c2C)cc1
InChIInChI=1S/C15H21N5O/c1-9-14(18-11(3)19-15(9)20-16)17-10(2)12-5-7-13(21-4)8-6-12/h5-8,10H,16H2,1-4H3,(H2,17,18,19,20)
InChIKeyZPALCJWVTDHLDW-UHFFFAOYSA-N
XLogP2.56
TPSA85.09 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 52.56
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

6-hydrazinyl-2,5-dimethyl-N-(1-pyridin-4-ylethyl)pyrimidin-4-amine
CID 80906911
5-ethyl-6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyrimidin-4-amine
CID 80924266
N-[1-(4-methoxyphenyl)ethyl]-2,6-dimethylpyrimidin-4-amine
CID 62047830
6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyrazin-2-amine
CID 80921639
4-N-[1-(4-chlorophenyl)ethyl]-2,5-dimethylpyrimidine-4,6-diamine
CID 80802407
2-N-[1-(4-methoxyphenyl)ethyl]-3-nitropyridine-2,6-diamine
CID 80832173
6-chloro-N-[1-(4-chlorophenyl)ethyl]-2,5-dimethylpyrimidin-4-amine
CID 63729135
5-chloro-N-[1-(4-methoxyphenyl)ethyl]-6-methylpyrimidin-4-amine
CID 15916528
2-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]pyridin-4-amine
CID 113368267
1-(4-methoxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]ethanamine
CID 12644064
5-amino-6-[1-(4-methoxyphenyl)ethylamino]pyridine-3-carbonitrile
CID 103468700
5-bromo-3-chloro-N-[1-(4-methoxyphenyl)ethyl]pyridin-2-amine
CID 103582571

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine (CID 80924119) is 6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine is COc1ccc(C(C)Nc2nc(C)nc(NN)c2C)cc1.
What is the InChIKey of 6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine?
The InChIKey is ZPALCJWVTDHLDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-9-14(18-11(3)19-15(9)20-16)17-10(2)12-5-7-13(21-4)8-6-12/h5-8,10H,16H2,1-4H3,(H2,17,18,19,20).
What are the key properties of 6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine?
6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine has a molecular weight of 287.37 g/mol, XLogP of 2.56, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-[1-(4-methoxyphenyl)ethyl]-2,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 80924119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).