(E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine

C17H26N2O — CID 87693183

IUPAC(E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine
SMILESCCC/C(=N\N)c1cccc(OCC2CCCCC2)c1
InChIInChI=1S/C17H26N2O/c1-2-7-17(19-18)15-10-6-11-16(12-15)20-13-14-8-4-3-5-9-14/h6,10-12,14H,2-5,7-9,13,18H2,1H3/b19-17+
InChIKeyFOHZSWMXRDKHJR-HTXNQAPBSA-N
MW274.41 g/mol
LogP4.11
Rot. Bonds6

About (E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine

(E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine (PubChem CID 87693183) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is (E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine.

Molecular Properties

Compound Name(E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine
PubChem CID87693183
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name(E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine
SMILESCCC/C(=N\N)c1cccc(OCC2CCCCC2)c1
InChIInChI=1S/C17H26N2O/c1-2-7-17(19-18)15-10-6-11-16(12-15)20-13-14-8-4-3-5-9-14/h6,10-12,14H,2-5,7-9,13,18H2,1H3/b19-17+
InChIKeyFOHZSWMXRDKHJR-HTXNQAPBSA-N
XLogP4.11
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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(3-propoxyphenoxy)methylcyclooctane
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1-[3-(cyclohexylmethoxy)phenyl]hexane-1,5-dione
CID 158607530
1-(cyclohexylmethoxy)-3-ethylbenzene
CID 64765854
(1R,2R)-2-(aminomethyl)-1-[3-(cyclohexylmethoxy)phenyl]pentan-1-ol
CID 174358586
3-(cyclobutylmethoxy)benzenecarboximidamide
CID 42656936
[3-(cyclopentylmethoxy)phenyl]-piperidin-1-ylmethanone
CID 126671401
1-amino-1-[3-(cycloheptylmethoxy)phenyl]propan-1-ol
CID 141350221
1-[3-(cyclopentylmethoxy)phenyl]ethanamine
CID 61344449
1-[3-(cyclohexylmethoxy)phenyl]propan-1-ol
CID 58097643

Frequently Asked Questions

What is the IUPAC name of (E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine?
The IUPAC name of (E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine (CID 87693183) is (E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine.
What is the SMILES notation for (E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine?
The canonical SMILES for (E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine is CCC/C(=N\N)c1cccc(OCC2CCCCC2)c1.
What is the InChIKey of (E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine?
The InChIKey is FOHZSWMXRDKHJR-HTXNQAPBSA-N. The full InChI is InChI=1S/C17H26N2O/c1-2-7-17(19-18)15-10-6-11-16(12-15)20-13-14-8-4-3-5-9-14/h6,10-12,14H,2-5,7-9,13,18H2,1H3/b19-17+.
What are the key properties of (E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine?
(E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine has a molecular weight of 274.41 g/mol, XLogP of 4.11, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-[3-(cyclohexylmethoxy)phenyl]butylidenehydrazine is sourced from PubChem (CID 87693183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).