N-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine

C14H19N5 — CID 103060861

IUPACN-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine
SMILESCCN(Cc1ccccc1)Cc1cnc(NN)cn1
InChIInChI=1S/C14H19N5/c1-2-19(10-12-6-4-3-5-7-12)11-13-8-17-14(18-15)9-16-13/h3-9H,2,10-11,15H2,1H3,(H,17,18)
InChIKeyIEUPPTFSGLYUDH-UHFFFAOYSA-N
MW257.34 g/mol
LogP1.78
Rot. Bonds6

About N-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine

N-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine (PubChem CID 103060861) has the molecular formula C14H19N5 and a molecular weight of 257.34 g/mol. Its IUPAC name is N-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine
PubChem CID103060861
Molecular FormulaC14H19N5
Molecular Weight257.34 g/mol
Exact Mass257.16
IUPAC NameN-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine
SMILESCCN(Cc1ccccc1)Cc1cnc(NN)cn1
InChIInChI=1S/C14H19N5/c1-2-19(10-12-6-4-3-5-7-12)11-13-8-17-14(18-15)9-16-13/h3-9H,2,10-11,15H2,1H3,(H,17,18)
InChIKeyIEUPPTFSGLYUDH-UHFFFAOYSA-N
XLogP1.78
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-Amino-5-phenylpyrazine
CID 598734
2-(2-(1-Methyl-4-phenyl-1H-imidazol-2-yl)ethyl)-6-(pyrazolidin-1-yl)pyrazine hydrochloride
CID 72706532
4-(Dimethylamino)benzaldehyde 2-pyridinylhydrazone
CID 5932401
2-(3,6-dimethyl-2-pyrazinyl)-2-methyl-N-phenylhydrazinecarbothioamide
CID 852690
1-[6-[3-[(E)-2-(2,3-dihydro-1H-tetrazol-5-yl)ethenyl]phenyl]pyrazin-2-yl]-4-methyl-1,4-diazepane
CID 44573315
5-(Pyrazin-2-yl)pyridin-2-amine
CID 59259225
6-Phenylpyrazin-2-amine
CID 12453550
2-Amino-3-phenylpyrazine
CID 13530132
2-(3,6-dimethyl-2-pyrazinyl)-2-methyl-N-(4-methylphenyl)hydrazinecarbothioamide
CID 852686
6-[4-[(dimethylamino)methyl]phenyl]-N-methylpyrazin-2-amine
CID 49792754
3-(Benzylamino)pyrazine-2,5-dicarbonitrile
CID 71533541
(1-Methyl-2,2-dioxo-7-phenylpyrazino[2,3-c][1,2,6]thiadiazin-4-yl)hydrazine
CID 10709618

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine?
The IUPAC name of N-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine (CID 103060861) is N-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine.
What is the SMILES notation for N-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine?
The canonical SMILES for N-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine is CCN(Cc1ccccc1)Cc1cnc(NN)cn1.
What is the InChIKey of N-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine?
The InChIKey is IEUPPTFSGLYUDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5/c1-2-19(10-12-6-4-3-5-7-12)11-13-8-17-14(18-15)9-16-13/h3-9H,2,10-11,15H2,1H3,(H,17,18).
What are the key properties of N-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine?
N-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine has a molecular weight of 257.34 g/mol, XLogP of 1.78, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-[(5-hydrazinylpyrazin-2-yl)methyl]ethanamine is sourced from PubChem (CID 103060861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).