3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine

C12H15N5 — CID 105223806

IUPAC3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine
SMILESNNC(c1ccccc1N)c1cnccc1N
InChIInChI=1S/C12H15N5/c13-10-4-2-1-3-8(10)12(17-15)9-7-16-6-5-11(9)14/h1-7,12,17H,13,15H2,(H2,14,16)
InChIKeyVDCLDZLNUJLVPQ-UHFFFAOYSA-N
MW229.29 g/mol
LogP0.80
Rot. Bonds3

About 3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine

3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine (PubChem CID 105223806) has the molecular formula C12H15N5 and a molecular weight of 229.29 g/mol. Its IUPAC name is 3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine.

Molecular Properties

Compound Name3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine
PubChem CID105223806
Molecular FormulaC12H15N5
Molecular Weight229.29 g/mol
Exact Mass229.13
IUPAC Name3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine
SMILESNNC(c1ccccc1N)c1cnccc1N
InChIInChI=1S/C12H15N5/c13-10-4-2-1-3-8(10)12(17-15)9-7-16-6-5-11(9)14/h1-7,12,17H,13,15H2,(H2,14,16)
InChIKeyVDCLDZLNUJLVPQ-UHFFFAOYSA-N
XLogP0.80
TPSA102.98 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.29
LogP ≤ 50.80
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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

3-[hydrazinyl-(2-methylphenyl)methyl]pyridin-4-amine
CID 105200409
3-(1-hydrazinylethyl)pyridin-4-amine
CID 105201253
3-[hydrazinyl-(3-methyl-2-pyridinyl)methyl]pyridin-4-amine
CID 105209198
3-[(4-bromo-2-fluorophenyl)-hydrazinylmethyl]pyridin-4-amine
CID 105280899
3-[(4-ethylphenyl)-hydrazinylmethyl]pyridin-4-amine
CID 105197356
3-[(4-bromo-3,5-dimethylphenyl)-hydrazinylmethyl]pyridin-4-amine
CID 105279471
[(2-iodophenyl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
CID 102710449
3-[2,3-dihydro-1,4-benzodioxin-3-yl(hydrazinyl)methyl]pyridin-4-amine
CID 105230197
3-[(2-aminophenyl)-hydrazinylmethyl]-4-methylpyridin-2-amine
CID 105223965
[(2,3-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105279808
[(3-chloro-4-pyridinyl)-(2-methoxyphenyl)methyl]hydrazine
CID 105285750
3-(3,3,3-trifluoro-1-hydrazinylpropyl)pyridin-4-amine
CID 105205967

Frequently Asked Questions

What is the IUPAC name of 3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine?
The IUPAC name of 3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine (CID 105223806) is 3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine.
What is the SMILES notation for 3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine?
The canonical SMILES for 3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine is NNC(c1ccccc1N)c1cnccc1N.
What is the InChIKey of 3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine?
The InChIKey is VDCLDZLNUJLVPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5/c13-10-4-2-1-3-8(10)12(17-15)9-7-16-6-5-11(9)14/h1-7,12,17H,13,15H2,(H2,14,16).
What are the key properties of 3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine?
3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine has a molecular weight of 229.29 g/mol, XLogP of 0.80, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-aminophenyl)-hydrazinylmethyl]pyridin-4-amine is sourced from PubChem (CID 105223806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).