[(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine

C13H22N4 — CID 105221018

IUPAC[(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine
SMILESCCC1CCCC(C(NN)c2ccncn2)C1
InChIInChI=1S/C13H22N4/c1-2-10-4-3-5-11(8-10)13(17-14)12-6-7-15-9-16-12/h6-7,9-11,13,17H,2-5,8,14H2,1H3
InChIKeyORSUMFGIRVWRNV-UHFFFAOYSA-N
MW234.35 g/mol
LogP2.20
Rot. Bonds4

About [(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine

[(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine (PubChem CID 105221018) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is [(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine.

Molecular Properties

Compound Name[(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine
PubChem CID105221018
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name[(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine
SMILESCCC1CCCC(C(NN)c2ccncn2)C1
InChIInChI=1S/C13H22N4/c1-2-10-4-3-5-11(8-10)13(17-14)12-6-7-15-9-16-12/h6-7,9-11,13,17H,2-5,8,14H2,1H3
InChIKeyORSUMFGIRVWRNV-UHFFFAOYSA-N
XLogP2.20
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[(3-ethylcyclohexyl)-(2-methylpyrimidin-4-yl)methyl]hydrazine
CID 105260496
[cyclopropyl(pyrimidin-4-yl)methyl]hydrazine
CID 105220873
3-[(3-ethylcyclohexyl)-hydrazinylmethyl]pyridin-2-amine
CID 105232901
[(2-chloro-4-pyridinyl)-(3-ethylcyclohexyl)methyl]hydrazine
CID 105252733
[(3-ethylcyclohexyl)-(2-methoxy-3-pyridinyl)methyl]hydrazine
CID 105313706
N-[cyclopentyl(pyrimidin-4-yl)methyl]propan-1-amine
CID 63990209
[(4-chlorophenyl)-(3-ethylcyclohexyl)methyl]hydrazine
CID 105193324
[(3-ethylcyclopentyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105233566
[(3-ethylcyclohexyl)-(2-methylphenyl)methyl]hydrazine
CID 105200437
[(2-chlorophenyl)-(3-ethylcyclohexyl)methyl]hydrazine
CID 105211066
[2,3-dihydro-1,4-benzodioxin-6-yl-(3-ethylcyclohexyl)methyl]hydrazine
CID 105232982
[(3-ethylcyclohexyl)-(2-propoxyphenyl)methyl]hydrazine
CID 105232856

Frequently Asked Questions

What is the IUPAC name of [(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine?
The IUPAC name of [(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine (CID 105221018) is [(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine.
What is the SMILES notation for [(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine?
The canonical SMILES for [(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine is CCC1CCCC(C(NN)c2ccncn2)C1.
What is the InChIKey of [(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine?
The InChIKey is ORSUMFGIRVWRNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-2-10-4-3-5-11(8-10)13(17-14)12-6-7-15-9-16-12/h6-7,9-11,13,17H,2-5,8,14H2,1H3.
What are the key properties of [(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine?
[(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine has a molecular weight of 234.35 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-ethylcyclohexyl)-pyrimidin-4-ylmethyl]hydrazine is sourced from PubChem (CID 105221018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).