1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine

C11H14N2O — CID 105315472

IUPAC1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine
SMILESC#CC(NN)c1cc(C)ccc1OC
InChIInChI=1S/C11H14N2O/c1-4-10(13-12)9-7-8(2)5-6-11(9)14-3/h1,5-7,10,13H,12H2,2-3H3
InChIKeyMMWDWGHHTCHQJY-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.14
Rot. Bonds3

About 1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine

1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine (PubChem CID 105315472) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine.

Molecular Properties

Compound Name1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine
PubChem CID105315472
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine
SMILESC#CC(NN)c1cc(C)ccc1OC
InChIInChI=1S/C11H14N2O/c1-4-10(13-12)9-7-8(2)5-6-11(9)14-3/h1,5-7,10,13H,12H2,2-3H3
InChIKeyMMWDWGHHTCHQJY-UHFFFAOYSA-N
XLogP1.14
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(2,4,5-trimethoxyphenyl)prop-2-ynylhydrazine
CID 105315476
1-(2,4-dimethoxyphenyl)prop-2-ynylhydrazine
CID 105315555
1-hydrazinyl-1-(2-methoxy-5-methylphenyl)-N-methylmethanamine
CID 116961705
[1-(2-methoxy-5-methylphenyl)-2,3-dimethylbutyl]hydrazine
CID 105303561
1-(2-methoxy-5-methylphenyl)prop-2-enylhydrazine
CID 105317957
[(2-methoxy-5-methylphenyl)-(2,4,6-trimethylphenyl)methyl]hydrazine
CID 105303521
[2-ethyl-1-(2-methoxy-5-methylphenyl)butyl]hydrazine
CID 105303451
[1-(2-methoxy-5-methylphenyl)-3,3-dimethylbutyl]hydrazine
CID 105220303
[(2-methoxy-5-methylphenyl)-(2,2,3,3-tetramethylcyclopropyl)methyl]hydrazine
CID 105303576
[2-(4-iodophenyl)-1-(2-methoxy-5-methylphenyl)ethyl]hydrazine
CID 105310239
[(2-methoxy-5-methylphenyl)-pyrimidin-2-ylmethyl]hydrazine
CID 105203659
1-(2-methoxy-4-methylphenyl)-N-propylprop-2-yn-1-amine
CID 106792543

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine?
The IUPAC name of 1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine (CID 105315472) is 1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine.
What is the SMILES notation for 1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine?
The canonical SMILES for 1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine is C#CC(NN)c1cc(C)ccc1OC.
What is the InChIKey of 1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine?
The InChIKey is MMWDWGHHTCHQJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-4-10(13-12)9-7-8(2)5-6-11(9)14-3/h1,5-7,10,13H,12H2,2-3H3.
What are the key properties of 1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine?
1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine has a molecular weight of 190.25 g/mol, XLogP of 1.14, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-5-methylphenyl)prop-2-ynylhydrazine is sourced from PubChem (CID 105315472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).