N-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide

C9H20N4 — CID 104882414

IUPACN-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide
SMILESCCC1CCC(C)N1/C(=N/C)NN
InChIInChI=1S/C9H20N4/c1-4-8-6-5-7(2)13(8)9(11-3)12-10/h7-8H,4-6,10H2,1-3H3,(H,11,12)
InChIKeyGZCQVGSTXIHHIV-UHFFFAOYSA-N
MW184.29 g/mol
LogP0.70
Rot. Bonds1

About N-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide

N-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide (PubChem CID 104882414) has the molecular formula C9H20N4 and a molecular weight of 184.29 g/mol. Its IUPAC name is N-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide.

Molecular Properties

Compound NameN-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide
PubChem CID104882414
Molecular FormulaC9H20N4
Molecular Weight184.29 g/mol
Exact Mass184.17
IUPAC NameN-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide
SMILESCCC1CCC(C)N1/C(=N/C)NN
InChIInChI=1S/C9H20N4/c1-4-8-6-5-7(2)13(8)9(11-3)12-10/h7-8H,4-6,10H2,1-3H3,(H,11,12)
InChIKeyGZCQVGSTXIHHIV-UHFFFAOYSA-N
XLogP0.70
TPSA53.65 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.29
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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'-ethylpyrrolidine-1-carboximidamide
CID 22977259
3-Amino-1-cyclohexyl-1,2-dimethylguanidine
CID 104881953
2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide
CID 83219043
N',2-diethyl-5-methylpyrrolidine-1-carboximidamide
CID 83219209
2-ethyl-5-methyl-N'-propan-2-ylpyrrolidine-1-carboximidamide
CID 83219210
N-(diaminomethylidene)-2-ethyl-5-methylpyrrolidine-1-carboximidamide
CID 83219554
2-ethyl-5-methyl-N'-propylpyrrolidine-1-carboximidamide
CID 83219841
N'-amino-2-ethyl-5-methylpyrrolidine-1-carboximidamide
CID 83219973
3-Amino-2-cyclohexyl-1-[3-(dimethylamino)propyl]-1-ethylguanidine
CID 102999137
3-Amino-2-cyclopentyl-1-[3-(dimethylamino)propyl]-1-ethylguanidine
CID 102999145
3-Amino-2-cyclopentyl-1-[3-(diethylamino)propyl]-1-ethylguanidine
CID 102999158
3-Amino-2-cyclohexyl-1-[1-(dimethylamino)propan-2-yl]-1-ethylguanidine
CID 103192658

Frequently Asked Questions

What is the IUPAC name of N-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide?
The IUPAC name of N-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide (CID 104882414) is N-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide.
What is the SMILES notation for N-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide?
The canonical SMILES for N-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide is CCC1CCC(C)N1/C(=N/C)NN.
What is the InChIKey of N-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide?
The InChIKey is GZCQVGSTXIHHIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N4/c1-4-8-6-5-7(2)13(8)9(11-3)12-10/h7-8H,4-6,10H2,1-3H3,(H,11,12).
What are the key properties of N-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide?
N-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide has a molecular weight of 184.29 g/mol, XLogP of 0.70, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-2-ethyl-N',5-dimethylpyrrolidine-1-carboximidamide is sourced from PubChem (CID 104882414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).