N'-ethyl-4-phenylpiperazine-1-carboximidamide

C13H20N4 — CID 55064093

IUPACN'-ethyl-4-phenylpiperazine-1-carboximidamide
SMILESCC/N=C(\N)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C13H20N4/c1-2-15-13(14)17-10-8-16(9-11-17)12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3,(H2,14,15)
InChIKeyCIDIZTOEGAGQFZ-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.14
Rot. Bonds2

About N'-ethyl-4-phenylpiperazine-1-carboximidamide

N'-ethyl-4-phenylpiperazine-1-carboximidamide (PubChem CID 55064093) has the molecular formula C13H20N4 and a molecular weight of 232.33 g/mol. Its IUPAC name is N'-ethyl-4-phenylpiperazine-1-carboximidamide.

Molecular Properties

Compound NameN'-ethyl-4-phenylpiperazine-1-carboximidamide
PubChem CID55064093
Molecular FormulaC13H20N4
Molecular Weight232.33 g/mol
Exact Mass232.17
IUPAC NameN'-ethyl-4-phenylpiperazine-1-carboximidamide
SMILESCC/N=C(\N)N1CCN(c2ccccc2)CC1
InChIInChI=1S/C13H20N4/c1-2-15-13(14)17-10-8-16(9-11-17)12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3,(H2,14,15)
InChIKeyCIDIZTOEGAGQFZ-UHFFFAOYSA-N
XLogP1.14
TPSA44.86 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.14
H-Bond Donors ≤ 51
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

N'-ethyl-4-(3-methylphenyl)piperazine-1-carboximidamide
CID 55064141
N'-(N'-octylcarbamimidoyl)-4-phenylpiperazine-1-carboximidamide;hydrochloride
CID 67218505
4-(4-fluorophenyl)-N'-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]piperazine-1-carboximidamide;hydroiodide
CID 111088954
N'-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]piperidine-1-carboximidamide;hydroiodide
CID 111092157
4-benzylidene-N'-ethylpiperidine-1-carboximidamide
CID 86814243
N'-cyano-4-phenylpiperazine-1-carboximidamide;ethene
CID 142010836
4-(4-chlorophenyl)-N'-propylpiperazine-1-carboximidamide;hydroiodide
CID 110911931
N'-ethyl-4-phenoxypiperidine-1-carboximidamide
CID 109426122
N-amino-N'-butyl-4-phenylpiperazine-1-carboximidamide
CID 116512916
4-methyl-N'-[4-(4-phenylpiperazin-1-yl)butyl]piperidine-1-carboximidamide
CID 110921127
1-(4-phenylpiperazin-1-yl)butane-1,2-dione
CID 70905363
4-(4-chlorophenyl)-N'-[(4-phenyl-1,2,4-triazol-3-yl)methyl]piperazine-1-carboximidamide
CID 111066058

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-4-phenylpiperazine-1-carboximidamide?
The IUPAC name of N'-ethyl-4-phenylpiperazine-1-carboximidamide (CID 55064093) is N'-ethyl-4-phenylpiperazine-1-carboximidamide.
What is the SMILES notation for N'-ethyl-4-phenylpiperazine-1-carboximidamide?
The canonical SMILES for N'-ethyl-4-phenylpiperazine-1-carboximidamide is CC/N=C(\N)N1CCN(c2ccccc2)CC1.
What is the InChIKey of N'-ethyl-4-phenylpiperazine-1-carboximidamide?
The InChIKey is CIDIZTOEGAGQFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4/c1-2-15-13(14)17-10-8-16(9-11-17)12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3,(H2,14,15).
What are the key properties of N'-ethyl-4-phenylpiperazine-1-carboximidamide?
N'-ethyl-4-phenylpiperazine-1-carboximidamide has a molecular weight of 232.33 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-4-phenylpiperazine-1-carboximidamide is sourced from PubChem (CID 55064093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).