[5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine

C12H21N5O — CID 80920960

IUPAC[5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine
SMILESCc1c(NN)ncnc1OCCN1CCCCC1
InChIInChI=1S/C12H21N5O/c1-10-11(16-13)14-9-15-12(10)18-8-7-17-5-3-2-4-6-17/h9H,2-8,13H2,1H3,(H,14,15,16)
InChIKeyCDZHGORCCIJAAD-UHFFFAOYSA-N
MW251.33 g/mol
LogP0.94
Rot. Bonds5

About [5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine

[5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine (PubChem CID 80920960) has the molecular formula C12H21N5O and a molecular weight of 251.33 g/mol. Its IUPAC name is [5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine
PubChem CID80920960
Molecular FormulaC12H21N5O
Molecular Weight251.33 g/mol
Exact Mass251.17
IUPAC Name[5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine
SMILESCc1c(NN)ncnc1OCCN1CCCCC1
InChIInChI=1S/C12H21N5O/c1-10-11(16-13)14-9-15-12(10)18-8-7-17-5-3-2-4-6-17/h9H,2-8,13H2,1H3,(H,14,15,16)
InChIKeyCDZHGORCCIJAAD-UHFFFAOYSA-N
XLogP0.94
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 50.94
H-Bond Donors ≤ 52
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-(azepan-1-yl)ethyl]-6-ethoxy-5-methylpyrimidin-4-amine
CID 66326640
N-methyl-6-(2-piperidin-1-ylethoxy)-5-propylpyrimidin-4-amine
CID 80870502
[5-methyl-6-(3-methylbutoxy)pyrimidin-4-yl]hydrazine
CID 80910715
6-hydrazinyl-5-methyl-N-piperidin-1-ylpyrimidin-4-amine
CID 83028115
[5-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-yl]hydrazine
CID 80920309
5-propan-2-yl-N-propyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine
CID 80879410
N-ethyl-2,5-dimethyl-6-(2-pyrrolidin-1-ylethoxy)pyrimidin-4-amine
CID 80871549
[2-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine
CID 80920622
4-(4-fluorophenyl)-5-methyl-6-(4-piperidin-1-ylbutoxy)pyrimidine
CID 21256782
1-methyl-3-(2-piperidin-1-ylethoxy)pyrazol-4-amine
CID 103079138
[5-methyl-6-[(2-methylpropan-2-yl)oxy]pyrimidin-4-yl]hydrazine
CID 80910587
5-methyl-2-(2-pyrrolidin-1-ylethoxy)pyridin-3-amine
CID 66279790

Frequently Asked Questions

What is the IUPAC name of [5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine?
The IUPAC name of [5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine (CID 80920960) is [5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine is Cc1c(NN)ncnc1OCCN1CCCCC1.
What is the InChIKey of [5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine?
The InChIKey is CDZHGORCCIJAAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O/c1-10-11(16-13)14-9-15-12(10)18-8-7-17-5-3-2-4-6-17/h9H,2-8,13H2,1H3,(H,14,15,16).
What are the key properties of [5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine?
[5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine has a molecular weight of 251.33 g/mol, XLogP of 0.94, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methyl-6-(2-piperidin-1-ylethoxy)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80920960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).