(3-methyl-4-propoxyphenyl)methylidenehydrazine

C11H16N2O — CID 168529274

IUPAC(3-methyl-4-propoxyphenyl)methylidenehydrazine
SMILESCCCOc1ccc(C=NN)cc1C
InChIInChI=1S/C11H16N2O/c1-3-6-14-11-5-4-10(8-13-12)7-9(11)2/h4-5,7-8H,3,6,12H2,1-2H3
InChIKeyGVLBPQWCUWPRIK-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.08
Rot. Bonds4

About (3-methyl-4-propoxyphenyl)methylidenehydrazine

(3-methyl-4-propoxyphenyl)methylidenehydrazine (PubChem CID 168529274) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is (3-methyl-4-propoxyphenyl)methylidenehydrazine.

Molecular Properties

Compound Name(3-methyl-4-propoxyphenyl)methylidenehydrazine
PubChem CID168529274
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name(3-methyl-4-propoxyphenyl)methylidenehydrazine
SMILESCCCOc1ccc(C=NN)cc1C
InChIInChI=1S/C11H16N2O/c1-3-6-14-11-5-4-10(8-13-12)7-9(11)2/h4-5,7-8H,3,6,12H2,1-2H3
InChIKeyGVLBPQWCUWPRIK-UHFFFAOYSA-N
XLogP2.08
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.08
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

(3-methyl-4-pentoxyphenyl)methylidenehydrazine
CID 168529268
(4-fluoro-3-propoxyphenyl)methylidenehydrazine
CID 168529277
(3-butoxy-4-methoxyphenyl)methylidenehydrazine
CID 168529239
[(4-butoxy-3-methylphenyl)methylideneamino]thiourea
CID 168534425
CID 69201774
CID 69201774
(E)-N-hydroxy-3-(3-methyl-4-propoxyphenyl)prop-2-enamide
CID 6433962
4-methyl-1-[(3-methyl-4-pentoxyphenyl)methylideneamino]imidazol-2-amine
CID 168628935
N-[(E)-(3-chloro-4-propoxyphenyl)methylideneamino]-4-methylaniline
CID 110505514
(3-ethoxy-4-propan-2-yloxyphenyl)methylidenehydrazine
CID 168529586
[(Z)-(3-chloro-4-propoxyphenyl)methylideneamino]urea
CID 110540127
N-[(E)-(3-bromo-4-propoxyphenyl)methylideneamino]-N-methylmethanamine
CID 110507419
tris(3-methyl-4-propoxyphenyl) borate
CID 70231539

Frequently Asked Questions

What is the IUPAC name of (3-methyl-4-propoxyphenyl)methylidenehydrazine?
The IUPAC name of (3-methyl-4-propoxyphenyl)methylidenehydrazine (CID 168529274) is (3-methyl-4-propoxyphenyl)methylidenehydrazine.
What is the SMILES notation for (3-methyl-4-propoxyphenyl)methylidenehydrazine?
The canonical SMILES for (3-methyl-4-propoxyphenyl)methylidenehydrazine is CCCOc1ccc(C=NN)cc1C.
What is the InChIKey of (3-methyl-4-propoxyphenyl)methylidenehydrazine?
The InChIKey is GVLBPQWCUWPRIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-3-6-14-11-5-4-10(8-13-12)7-9(11)2/h4-5,7-8H,3,6,12H2,1-2H3.
What are the key properties of (3-methyl-4-propoxyphenyl)methylidenehydrazine?
(3-methyl-4-propoxyphenyl)methylidenehydrazine has a molecular weight of 192.26 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-4-propoxyphenyl)methylidenehydrazine is sourced from PubChem (CID 168529274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).