N-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide

C10H24N6 — CID 104881912

IUPACN-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide
SMILESC/N=C(\NN)N1CCN(CCN(C)C)CC1
InChIInChI=1S/C10H24N6/c1-12-10(13-11)16-8-6-15(7-9-16)5-4-14(2)3/h4-9,11H2,1-3H3,(H,12,13)
InChIKeyBEDZSOBCSXWLPA-UHFFFAOYSA-N
MW228.34 g/mol
LogP-1.39
Rot. Bonds3

About N-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide

N-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide (PubChem CID 104881912) has the molecular formula C10H24N6 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide.

Molecular Properties

Compound NameN-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide
PubChem CID104881912
Molecular FormulaC10H24N6
Molecular Weight228.34 g/mol
Exact Mass228.21
IUPAC NameN-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide
SMILESC/N=C(\NN)N1CCN(CCN(C)C)CC1
InChIInChI=1S/C10H24N6/c1-12-10(13-11)16-8-6-15(7-9-16)5-4-14(2)3/h4-9,11H2,1-3H3,(H,12,13)
InChIKeyBEDZSOBCSXWLPA-UHFFFAOYSA-N
XLogP-1.39
TPSA60.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 5-1.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-amino-N'-methyl-4-(2-methylpropyl)piperazine-1-carboximidamide
CID 104881910
N-amino-4-ethyl-N'-methylpiperidine-1-carboximidamide
CID 104882168
N-amino-N'-ethyl-4-(2-hydroxyethyl)piperazine-1-carboximidamide
CID 104883423
4-[2-(dimethylamino)ethyl]-N'-(2-methylpropyl)piperazine-1-carboximidamide
CID 62890381
N-amino-4-(methoxymethyl)-N'-methylpiperidine-1-carboximidamide
CID 104882225
N-amino-N'-propan-2-yl-4-propylpiperazine-1-carboximidamide
CID 104883166
N,N-dimethyl-2-(4-methylpiperazin-1-yl)ethanamine;ethane
CID 143417406
1-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2-methyl-2-(methylamino)propan-1-one
CID 55128614
3-amino-1-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-3-methylbutan-1-one
CID 64679136
2-bromo-1-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2-methylpropan-1-one
CID 114328631
6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-3,3-dimethylhexan-1-amine
CID 65296194
N,N-dimethyl-2-(4-propanimidoylpiperazin-1-yl)ethanamine
CID 63174383

Frequently Asked Questions

What is the IUPAC name of N-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide?
The IUPAC name of N-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide (CID 104881912) is N-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide.
What is the SMILES notation for N-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide?
The canonical SMILES for N-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide is C/N=C(\NN)N1CCN(CCN(C)C)CC1.
What is the InChIKey of N-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide?
The InChIKey is BEDZSOBCSXWLPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N6/c1-12-10(13-11)16-8-6-15(7-9-16)5-4-14(2)3/h4-9,11H2,1-3H3,(H,12,13).
What are the key properties of N-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide?
N-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide has a molecular weight of 228.34 g/mol, XLogP of -1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-4-[2-(dimethylamino)ethyl]-N'-methylpiperazine-1-carboximidamide is sourced from PubChem (CID 104881912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).