2-(hydrazinylmethyl)aniline

C7H11N3 — CID 126609519

IUPAC2-(hydrazinylmethyl)aniline
SMILESNNCc1ccccc1N
InChIInChI=1S/C7H11N3/c8-7-4-2-1-3-6(7)5-10-9/h1-4,10H,5,8-9H2
InChIKeyITEMHIBDYSLADM-UHFFFAOYSA-N
MW137.19 g/mol
LogP0.23
Rot. Bonds2

About 2-(hydrazinylmethyl)aniline

2-(hydrazinylmethyl)aniline (PubChem CID 126609519) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is 2-(hydrazinylmethyl)aniline.

Molecular Properties

Compound Name2-(hydrazinylmethyl)aniline
PubChem CID126609519
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC Name2-(hydrazinylmethyl)aniline
SMILESNNCc1ccccc1N
InChIInChI=1S/C7H11N3/c8-7-4-2-1-3-6(7)5-10-9/h1-4,10H,5,8-9H2
InChIKeyITEMHIBDYSLADM-UHFFFAOYSA-N
XLogP0.23
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 50.23
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-methylphenyl)methylhydrazine;hydrochloride
CID 42940672
2-[(2-aminophenyl)methylamino]propane-1,3-diol
CID 66417695
ethane;(2-fluorophenyl)methylhydrazine
CID 142817687
2-[(2-chloroanilino)methyl]aniline
CID 66387029
N-[(2-aminophenyl)methyl]-2,6-dichloroaniline
CID 66418277
N-[(2-aminophenyl)methyl]-2,6-difluoroaniline
CID 66385039
2-(aminomethyl)aniline;hydrochloride
CID 69170371
(2-aminophenyl)methyloxidanium
CID 164683115
2-ethylaniline;propane
CID 143529464
ethane;2-ethylaniline
CID 90841248
2-[(2-aminophenyl)methylamino]propan-1-ol
CID 66386252
N-[(2-aminophenyl)methyl]-2-oxopropanamide
CID 110478407

Frequently Asked Questions

What is the IUPAC name of 2-(hydrazinylmethyl)aniline?
The IUPAC name of 2-(hydrazinylmethyl)aniline (CID 126609519) is 2-(hydrazinylmethyl)aniline.
What is the SMILES notation for 2-(hydrazinylmethyl)aniline?
The canonical SMILES for 2-(hydrazinylmethyl)aniline is NNCc1ccccc1N.
What is the InChIKey of 2-(hydrazinylmethyl)aniline?
The InChIKey is ITEMHIBDYSLADM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3/c8-7-4-2-1-3-6(7)5-10-9/h1-4,10H,5,8-9H2.
What are the key properties of 2-(hydrazinylmethyl)aniline?
2-(hydrazinylmethyl)aniline has a molecular weight of 137.19 g/mol, XLogP of 0.23, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(hydrazinylmethyl)aniline is sourced from PubChem (CID 126609519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).