2-hydrazinyl-3-methylaniline

C7H11N3 — CID 118990747

IUPAC2-hydrazinyl-3-methylaniline
SMILESCc1cccc(N)c1NN
InChIInChI=1S/C7H11N3/c1-5-3-2-4-6(8)7(5)10-9/h2-4,10H,8-9H2,1H3
InChIKeyAEZGYXXXLQQWEK-UHFFFAOYSA-N
MW137.19 g/mol
LogP0.86
Rot. Bonds1

About 2-hydrazinyl-3-methylaniline

2-hydrazinyl-3-methylaniline (PubChem CID 118990747) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is 2-hydrazinyl-3-methylaniline.

Molecular Properties

Compound Name2-hydrazinyl-3-methylaniline
PubChem CID118990747
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC Name2-hydrazinyl-3-methylaniline
SMILESCc1cccc(N)c1NN
InChIInChI=1S/C7H11N3/c1-5-3-2-4-6(8)7(5)10-9/h2-4,10H,8-9H2,1H3
InChIKeyAEZGYXXXLQQWEK-UHFFFAOYSA-N
XLogP0.86
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 50.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-hydrazinyl-3-methylphenol
CID 130966480
2-N-tert-butyl-3-methylbenzene-1,2-diamine
CID 70363393
3-methyl-2-N-(2-methylpropyl)benzene-1,2-diamine
CID 82668611
CID 175394275
CID 175394275
CID 67897123
CID 67897123
2-methylaniline;dihydrochloride
CID 23331471
CID 159002136
CID 159002136
tris(2-methylaniline);phosphane
CID 158408493
2-(2-amino-6-methylanilino)-2-(hydroxymethyl)propane-1,3-diol
CID 107845627
2-(2-amino-6-methylanilino)propane-1,3-diol
CID 115550630
2,6-dimethylaniline;2-methylaniline
CID 160714609
2-N-(2,4-dimethylphenyl)-3-methylbenzene-1,2-diamine
CID 115550017

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-3-methylaniline?
The IUPAC name of 2-hydrazinyl-3-methylaniline (CID 118990747) is 2-hydrazinyl-3-methylaniline.
What is the SMILES notation for 2-hydrazinyl-3-methylaniline?
The canonical SMILES for 2-hydrazinyl-3-methylaniline is Cc1cccc(N)c1NN.
What is the InChIKey of 2-hydrazinyl-3-methylaniline?
The InChIKey is AEZGYXXXLQQWEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3/c1-5-3-2-4-6(8)7(5)10-9/h2-4,10H,8-9H2,1H3.
What are the key properties of 2-hydrazinyl-3-methylaniline?
2-hydrazinyl-3-methylaniline has a molecular weight of 137.19 g/mol, XLogP of 0.86, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-3-methylaniline is sourced from PubChem (CID 118990747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).