[3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine

C13H20N2O2 — CID 168530321

IUPAC[3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine
SMILESCC(C)Oc1cc(C=NN)cc(OC(C)C)c1
InChIInChI=1S/C13H20N2O2/c1-9(2)16-12-5-11(8-15-14)6-13(7-12)17-10(3)4/h5-10H,14H2,1-4H3
InChIKeyRTSXKFZGFHQAOH-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.55
Rot. Bonds5

About [3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine

[3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine (PubChem CID 168530321) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is [3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine.

Molecular Properties

Compound Name[3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine
PubChem CID168530321
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name[3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine
SMILESCC(C)Oc1cc(C=NN)cc(OC(C)C)c1
InChIInChI=1S/C13H20N2O2/c1-9(2)16-12-5-11(8-15-14)6-13(7-12)17-10(3)4/h5-10H,14H2,1-4H3
InChIKeyRTSXKFZGFHQAOH-UHFFFAOYSA-N
XLogP2.55
TPSA56.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

(3,5-dimethoxyphenyl)methylidenehydrazine
CID 131871774
(3-methoxy-4-propan-2-yloxyphenyl)methylidenehydrazine
CID 168529581
3-chloro-5-propan-2-yloxybenzaldehyde
CID 131540218
(3-ethoxy-4-propan-2-yloxyphenyl)methylidenehydrazine
CID 168529586
2-[3,5-di(propan-2-yloxy)phenyl]-3,4,5,6-tetrafluorobenzaldehyde
CID 87295486
(5-methoxy-3-pyridinyl)methylidenehydrazine
CID 69400382
1-bromo-3-ethenyl-5-propan-2-yloxybenzene
CID 156599987
N-[(Z)-(3,5-dimethoxyphenyl)methylideneamino]-4-propan-2-yloxybenzamide
CID 9215270
1,3-dibromo-5-propan-2-yloxybenzene
CID 50998234
ethane;1-methyl-3-[(Z)-3-methylbut-1-enyl]-5-propan-2-yloxybenzene
CID 142213389
(5-chloro-3-methoxy-2-propan-2-yloxyphenyl)methylidenehydrazine
CID 168530261
(E)-4-(3-propan-2-yloxyphenyl)but-3-en-2-amine
CID 103091447

Frequently Asked Questions

What is the IUPAC name of [3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine?
The IUPAC name of [3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine (CID 168530321) is [3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine.
What is the SMILES notation for [3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine?
The canonical SMILES for [3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine is CC(C)Oc1cc(C=NN)cc(OC(C)C)c1.
What is the InChIKey of [3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine?
The InChIKey is RTSXKFZGFHQAOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-9(2)16-12-5-11(8-15-14)6-13(7-12)17-10(3)4/h5-10H,14H2,1-4H3.
What are the key properties of [3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine?
[3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine has a molecular weight of 236.31 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3,5-di(propan-2-yloxy)phenyl]methylidenehydrazine is sourced from PubChem (CID 168530321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).