N-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen

C8H18N4 — CID 142160666

IUPACN-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen
SMILESC=CN/C(=N\C)N1CCNCC1.[H][H]
InChIInChI=1S/C8H16N4.H2/c1-3-11-8(9-2)12-6-4-10-5-7-12;/h3,10H,1,4-7H2,2H3,(H,9,11);1H
InChIKeyFLLIDHLJLVWUHQ-UHFFFAOYSA-N
MW170.26 g/mol
LogP-0.14
Rot. Bonds1

About N-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen

N-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen (PubChem CID 142160666) has the molecular formula C8H18N4 and a molecular weight of 170.26 g/mol. Its IUPAC name is N-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen.

Molecular Properties

Compound NameN-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen
PubChem CID142160666
Molecular FormulaC8H18N4
Molecular Weight170.26 g/mol
Exact Mass170.15
IUPAC NameN-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen
SMILESC=CN/C(=N\C)N1CCNCC1.[H][H]
InChIInChI=1S/C8H16N4.H2/c1-3-11-8(9-2)12-6-4-10-5-7-12;/h3,10H,1,4-7H2,2H3,(H,9,11);1H
InChIKeyFLLIDHLJLVWUHQ-UHFFFAOYSA-N
XLogP-0.14
TPSA39.66 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

1,3-Diethyl-2-[2-(4-methylpiperazin-1-yl)ethyl]guanidine
CID 53604504
1-(4,5-dihydro-1H-imidazol-2-yl)-4-methylpiperazine
CID 12435105
1-(1-Methyl-4,5-dihydroimidazol-2-yl)piperazine
CID 18424134
N,N',4-trimethylpiperazine-1-carboximidamide
CID 22957304
N,N,N'-trimethylpiperazine-1-carboximidamide
CID 22957306
N,N'-dimethylpiperazine-1-carboximidamide
CID 22977268
2-(4-Methylpiperazin-1-yl)-1,4-dihydropyrimidine
CID 54066096
3-(piperazin-1-ylmethyl)-4H-pyrimidine
CID 90821929
N-ethyl-N'-methylpiperazine-1-carboximidamide
CID 91223768
1-(4,5-dihydro-1H-imidazol-2-yl)-4-ethylpiperazine
CID 121472706
N-methylidene-N'-[(Z)-prop-1-enyl]piperazine-1-carboximidamide
CID 129253175
5-ethenyl-N-ethyl-6-ethylimino-1,4-dihydro-1,3,5-triazin-2-amine
CID 141273664

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen?
The IUPAC name of N-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen (CID 142160666) is N-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen.
What is the SMILES notation for N-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen?
The canonical SMILES for N-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen is C=CN/C(=N\C)N1CCNCC1.[H][H].
What is the InChIKey of N-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen?
The InChIKey is FLLIDHLJLVWUHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N4.H2/c1-3-11-8(9-2)12-6-4-10-5-7-12;/h3,10H,1,4-7H2,2H3,(H,9,11);1H.
What are the key properties of N-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen?
N-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen has a molecular weight of 170.26 g/mol, XLogP of -0.14, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N'-methylpiperazine-1-carboximidamide;molecular hydrogen is sourced from PubChem (CID 142160666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).