azane;3-hydrazinylbenzaldehyde

C7H11N3O — CID 142389846

IUPACazane;3-hydrazinylbenzaldehyde
SMILESN.NNc1cccc(C=O)c1
InChIInChI=1S/C7H8N2O.H3N/c8-9-7-3-1-2-6(4-7)5-10;/h1-5,9H,8H2;1H3
InChIKeyLOBCEGZPSIURTN-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.95
Rot. Bonds2

About azane;3-hydrazinylbenzaldehyde

azane;3-hydrazinylbenzaldehyde (PubChem CID 142389846) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is azane;3-hydrazinylbenzaldehyde.

Molecular Properties

Compound Nameazane;3-hydrazinylbenzaldehyde
PubChem CID142389846
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Nameazane;3-hydrazinylbenzaldehyde
SMILESN.NNc1cccc(C=O)c1
InChIInChI=1S/C7H8N2O.H3N/c8-9-7-3-1-2-6(4-7)5-10;/h1-5,9H,8H2;1H3
InChIKeyLOBCEGZPSIURTN-UHFFFAOYSA-N
XLogP0.95
TPSA90.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(3-ethenylphenyl)hydrazine;hydrochloride
CID 67928717
5-hydrazinylbenzene-1,3-dicarbaldehyde
CID 131191320
3-(2-fluoroethylamino)benzaldehyde
CID 84652613
benzene-1,3-dicarbaldehyde;ethane
CID 91375977
3-[4-(tert-butylamino)anilino]benzaldehyde
CID 168860115
N-(3-formylphenyl)cyclopropanecarboxamide
CID 106912504
3-(2-methoxyethylamino)benzaldehyde
CID 88893508
benzene-1,3-dicarbaldehyde;carbon monoxide;chromium
CID 11161539
1-(4-cyanophenyl)-3-(3-formylphenyl)urea
CID 106912803
3-(pentan-2-ylamino)benzaldehyde
CID 107887286
2-(2-aminophenyl)-N-(3-formylphenyl)acetamide
CID 162521293
3-(anilinomethyl)benzaldehyde
CID 87371298

Frequently Asked Questions

What is the IUPAC name of azane;3-hydrazinylbenzaldehyde?
The IUPAC name of azane;3-hydrazinylbenzaldehyde (CID 142389846) is azane;3-hydrazinylbenzaldehyde.
What is the SMILES notation for azane;3-hydrazinylbenzaldehyde?
The canonical SMILES for azane;3-hydrazinylbenzaldehyde is N.NNc1cccc(C=O)c1.
What is the InChIKey of azane;3-hydrazinylbenzaldehyde?
The InChIKey is LOBCEGZPSIURTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O.H3N/c8-9-7-3-1-2-6(4-7)5-10;/h1-5,9H,8H2;1H3.
What are the key properties of azane;3-hydrazinylbenzaldehyde?
azane;3-hydrazinylbenzaldehyde has a molecular weight of 153.18 g/mol, XLogP of 0.95, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azane;3-hydrazinylbenzaldehyde is sourced from PubChem (CID 142389846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).