4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide

C11H25N5 — CID 3069720

IUPAC4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide
SMILES[H]/N=C(\N)N1CCN(CCN(CC)CC)CC1
InChIInChI=1S/C11H25N5/c1-3-14(4-2)5-6-15-7-9-16(10-8-15)11(12)13/h3-10H2,1-2H3,(H3,12,13)
InChIKeyRHTROOWEZILQJX-UHFFFAOYSA-N
MW227.36 g/mol
LogP-0.16
Rot. Bonds5

About 4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide

4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide (PubChem CID 3069720) has the molecular formula C11H25N5 and a molecular weight of 227.36 g/mol. Its IUPAC name is 4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide.

Molecular Properties

Compound Name4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide
PubChem CID3069720
Molecular FormulaC11H25N5
Molecular Weight227.36 g/mol
Exact Mass227.21
IUPAC Name4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide
SMILES[H]/N=C(\N)N1CCN(CCN(CC)CC)CC1
InChIInChI=1S/C11H25N5/c1-3-14(4-2)5-6-15-7-9-16(10-8-15)11(12)13/h3-10H2,1-2H3,(H3,12,13)
InChIKeyRHTROOWEZILQJX-UHFFFAOYSA-N
XLogP-0.16
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.36
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

4-Methylpiperazine-1-carboximidamide
CID 2760028
1,4-Piperazinedicarboxamidine
CID 205054
1-[2-[Carbamimidoyl(methyl)amino]ethyl]-1-methyl-guanidine
CID 469978
1-[Amino(4-methylpiperazin-1-yl)methylidene]guanidine dihydrochloride
CID 12256110
N-[amino(4-methylpiperazin-1-yl)methylidene]guanidine dihydrochloride
CID 176519436
N'-carbamimidoyl-4-methylpiperazine-1-carboximidamide;dihydrochloride
CID 176530095
4-Ethylpiperazine-1-carboximidamide
CID 4885940
N'-(2-aminoethyl)-4-methylpiperazine-1-carboximidamide
CID 91599877
4-(2-Fluoroethyl)piperazine-1-carboximidamide
CID 121201956
1-[2-(Dimethylamino)ethyl]-1-methylguanidine
CID 352213
4-(Propan-2-yl)piperazine-1-carboximidamide
CID 2759510
N-[amino(imino)methyl]-4-methylpiperazine-1-carboximidamide
CID 10285845

Frequently Asked Questions

What is the IUPAC name of 4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide?
The IUPAC name of 4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide (CID 3069720) is 4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide.
What is the SMILES notation for 4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide?
The canonical SMILES for 4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide is [H]/N=C(\N)N1CCN(CCN(CC)CC)CC1.
What is the InChIKey of 4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide?
The InChIKey is RHTROOWEZILQJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N5/c1-3-14(4-2)5-6-15-7-9-16(10-8-15)11(12)13/h3-10H2,1-2H3,(H3,12,13).
What are the key properties of 4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide?
4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide has a molecular weight of 227.36 g/mol, XLogP of -0.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(diethylamino)ethyl]piperazine-1-carboximidamide is sourced from PubChem (CID 3069720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).