[(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine

C16H30N4O — CID 105232753

IUPAC[(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
SMILESCOc1cnn(C)c1C(NN)C1CCC(C(C)(C)C)CC1
InChIInChI=1S/C16H30N4O/c1-16(2,3)12-8-6-11(7-9-12)14(19-17)15-13(21-5)10-18-20(15)4/h10-12,14,19H,6-9,17H2,1-5H3
InChIKeyNKZIDVKCCPSWPG-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.79
Rot. Bonds4

About [(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine

[(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine (PubChem CID 105232753) has the molecular formula C16H30N4O and a molecular weight of 294.44 g/mol. Its IUPAC name is [(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
PubChem CID105232753
Molecular FormulaC16H30N4O
Molecular Weight294.44 g/mol
Exact Mass294.24
IUPAC Name[(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
SMILESCOc1cnn(C)c1C(NN)C1CCC(C(C)(C)C)CC1
InChIInChI=1S/C16H30N4O/c1-16(2,3)12-8-6-11(7-9-12)14(19-17)15-13(21-5)10-18-20(15)4/h10-12,14,19H,6-9,17H2,1-5H3
InChIKeyNKZIDVKCCPSWPG-UHFFFAOYSA-N
XLogP2.79
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.79
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

[(4,4-dimethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105231780
[2,3-dihydro-1H-inden-2-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105234228
[(1,1-dioxothiolan-3-yl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105258954
[6-bicyclo[3.1.0]hexanyl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105339126
cyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine
CID 114646874
1-(4,4-difluorocyclohexyl)-1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylmethanamine
CID 105186369
1-(4-methoxy-1-methylpyrazol-5-yl)ethylhydrazine
CID 105201324
[(3-ethylcyclopentyl)-(1-ethyl-4-methoxypyrazol-5-yl)methyl]hydrazine
CID 105233464
[3,4-dihydro-2H-chromen-4-yl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105233842
[(4-methoxy-1-methylpyrazol-5-yl)-(4-propan-2-ylmorpholin-2-yl)methyl]hydrazine
CID 105248155
(4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine
CID 114655202
1-(4-methoxy-1-methylpyrazol-5-yl)-2,2-dimethylbutan-1-amine
CID 105047205

Frequently Asked Questions

What is the IUPAC name of [(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
The IUPAC name of [(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine (CID 105232753) is [(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
The canonical SMILES for [(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine is COc1cnn(C)c1C(NN)C1CCC(C(C)(C)C)CC1.
What is the InChIKey of [(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
The InChIKey is NKZIDVKCCPSWPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4O/c1-16(2,3)12-8-6-11(7-9-12)14(19-17)15-13(21-5)10-18-20(15)4/h10-12,14,19H,6-9,17H2,1-5H3.
What are the key properties of [(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine?
[(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine has a molecular weight of 294.44 g/mol, XLogP of 2.79, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105232753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).