1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine

C14H20N5+ — CID 123362947

IUPAC1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine
SMILESNNCc1cc[n+](NNCCc2ccccc2)cc1
InChIInChI=1S/C14H20N5/c15-16-12-14-7-10-19(11-8-14)18-17-9-6-13-4-2-1-3-5-13/h1-5,7-8,10-11,16-18H,6,9,12,15H2/q+1
InChIKeyWGMZWSKGKABKIG-UHFFFAOYSA-N
MW258.35 g/mol
LogP0.23
Rot. Bonds7

About 1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine

1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine (PubChem CID 123362947) has the molecular formula C14H20N5+ and a molecular weight of 258.35 g/mol. Its IUPAC name is 1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine.

Molecular Properties

Compound Name1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine
PubChem CID123362947
Molecular FormulaC14H20N5+
Molecular Weight258.35 g/mol
Exact Mass258.17
IUPAC Name1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine
SMILESNNCc1cc[n+](NNCCc2ccccc2)cc1
InChIInChI=1S/C14H20N5/c15-16-12-14-7-10-19(11-8-14)18-17-9-6-13-4-2-1-3-5-13/h1-5,7-8,10-11,16-18H,6,9,12,15H2/q+1
InChIKeyWGMZWSKGKABKIG-UHFFFAOYSA-N
XLogP0.23
TPSA65.99 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 50.23
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Related Compounds

alumane;benzylhydrazine
CID 175014660
1-ethyl-2-(2-phenylethyl)hydrazine
CID 154352967
N-(2-phenylethyl)pyridin-1-ium-1-amine
CID 135357594
N-[(4-ethylphenyl)methyl]-2-phenylethanamine;hydrochloride
CID 17289928
N-benzyl-2-(4-propylphenyl)ethanamine
CID 68807440
1-(2-phenylethyl)-2-(3-phenylpropyl)hydrazine
CID 56631422
2-phenylethylhydrazine;trans-(1R,2S)-2-phenylcyclopropan-1-amine
CID 67382394
1-amino-3-(2-phenylethylamino)urea
CID 150752697
N-benzyl-2-phenylethanamine;butane-1,4-diamine
CID 23298616
(1E,3Z)-4-aminobuta-1,3-diene-1-thiol;benzylhydrazine
CID 176993650
N-chloro-2-phenylethanamine
CID 18184165
N-alumanyl-2-phenylethanamine
CID 173457545

Frequently Asked Questions

What is the IUPAC name of 1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine?
The IUPAC name of 1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine (CID 123362947) is 1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine.
What is the SMILES notation for 1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine?
The canonical SMILES for 1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine is NNCc1cc[n+](NNCCc2ccccc2)cc1.
What is the InChIKey of 1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine?
The InChIKey is WGMZWSKGKABKIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N5/c15-16-12-14-7-10-19(11-8-14)18-17-9-6-13-4-2-1-3-5-13/h1-5,7-8,10-11,16-18H,6,9,12,15H2/q+1.
What are the key properties of 1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine?
1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine has a molecular weight of 258.35 g/mol, XLogP of 0.23, 7 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(hydrazinylmethyl)pyridin-1-ium-1-yl]-2-(2-phenylethyl)hydrazine is sourced from PubChem (CID 123362947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).