[4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine

C13H22N4O — CID 80922380

IUPAC[4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine
SMILESCc1cnc(NN)nc1OC1CC(C)CC(C)C1
InChIInChI=1S/C13H22N4O/c1-8-4-9(2)6-11(5-8)18-12-10(3)7-15-13(16-12)17-14/h7-9,11H,4-6,14H2,1-3H3,(H,15,16,17)
InChIKeyACITZAIOLVOWJN-UHFFFAOYSA-N
MW250.35 g/mol
LogP2.27
Rot. Bonds3

About [4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine

[4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine (PubChem CID 80922380) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is [4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine
PubChem CID80922380
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name[4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine
SMILESCc1cnc(NN)nc1OC1CC(C)CC(C)C1
InChIInChI=1S/C13H22N4O/c1-8-4-9(2)6-11(5-8)18-12-10(3)7-15-13(16-12)17-14/h7-9,11H,4-6,14H2,1-3H3,(H,15,16,17)
InChIKeyACITZAIOLVOWJN-UHFFFAOYSA-N
XLogP2.27
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

[5-methyl-4-(3,3,5-trimethylcyclohexyl)oxypyrimidin-2-yl]hydrazine
CID 80909017
[5-chloro-4-(3,5-dimethylcyclohexyl)oxypyrimidin-2-yl]hydrazine
CID 80921386
(4-cyclohexyloxy-5-methylpyrimidin-2-yl)hydrazine
CID 80909752
4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-amine
CID 80878483
[5-bromo-4-(3-methylcyclohexyl)oxypyrimidin-2-yl]hydrazine
CID 80910470
6-(3,5-dimethylcyclohexyl)oxy-5-methylpyridin-3-amine
CID 64730372
N-ethyl-5-methyl-4-(oxetan-3-yloxy)pyrimidin-2-amine
CID 102608905
4-(4,4-dimethylcyclohexyl)oxy-N,5-dimethylpyrimidin-2-amine
CID 114342911
5-methyl-4-(4-methylcyclohexyl)oxypyrimidin-2-amine
CID 80858351
4-cycloheptyloxy-N-ethyl-5-methylpyrimidin-2-amine
CID 80871066
4-(3,5-dimethylcyclohexyl)oxy-N,6-dimethylthieno[2,3-d]pyrimidin-2-amine
CID 103332845
[4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80925332

Frequently Asked Questions

What is the IUPAC name of [4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine?
The IUPAC name of [4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine (CID 80922380) is [4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine.
What is the SMILES notation for [4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine?
The canonical SMILES for [4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine is Cc1cnc(NN)nc1OC1CC(C)CC(C)C1.
What is the InChIKey of [4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine?
The InChIKey is ACITZAIOLVOWJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-8-4-9(2)6-11(5-8)18-12-10(3)7-15-13(16-12)17-14/h7-9,11H,4-6,14H2,1-3H3,(H,15,16,17).
What are the key properties of [4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine?
[4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine has a molecular weight of 250.35 g/mol, XLogP of 2.27, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3,5-dimethylcyclohexyl)oxy-5-methylpyrimidin-2-yl]hydrazine is sourced from PubChem (CID 80922380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).