N-amino-N'-methylpyrrolidine-1-carboximidamide

C6H14N4 — CID 89196844

IUPACN-amino-N'-methylpyrrolidine-1-carboximidamide
SMILESC/N=C(\NN)N1CCCC1
InChIInChI=1S/C6H14N4/c1-8-6(9-7)10-4-2-3-5-10/h2-5,7H2,1H3,(H,8,9)
InChIKeyJCASIJUUXRHIEE-UHFFFAOYSA-N
MW142.21 g/mol
LogP-0.47
Rot. Bonds

About N-amino-N'-methylpyrrolidine-1-carboximidamide

N-amino-N'-methylpyrrolidine-1-carboximidamide (PubChem CID 89196844) has the molecular formula C6H14N4 and a molecular weight of 142.21 g/mol. Its IUPAC name is N-amino-N'-methylpyrrolidine-1-carboximidamide.

Molecular Properties

Compound NameN-amino-N'-methylpyrrolidine-1-carboximidamide
PubChem CID89196844
Molecular FormulaC6H14N4
Molecular Weight142.21 g/mol
Exact Mass142.12
IUPAC NameN-amino-N'-methylpyrrolidine-1-carboximidamide
SMILESC/N=C(\NN)N1CCCC1
InChIInChI=1S/C6H14N4/c1-8-6(9-7)10-4-2-3-5-10/h2-5,7H2,1H3,(H,8,9)
InChIKeyJCASIJUUXRHIEE-UHFFFAOYSA-N
XLogP-0.47
TPSA53.65 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.21
LogP ≤ 5-0.47
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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Frequently Asked Questions

What is the IUPAC name of N-amino-N'-methylpyrrolidine-1-carboximidamide?
The IUPAC name of N-amino-N'-methylpyrrolidine-1-carboximidamide (CID 89196844) is N-amino-N'-methylpyrrolidine-1-carboximidamide.
What is the SMILES notation for N-amino-N'-methylpyrrolidine-1-carboximidamide?
The canonical SMILES for N-amino-N'-methylpyrrolidine-1-carboximidamide is C/N=C(\NN)N1CCCC1.
What is the InChIKey of N-amino-N'-methylpyrrolidine-1-carboximidamide?
The InChIKey is JCASIJUUXRHIEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N4/c1-8-6(9-7)10-4-2-3-5-10/h2-5,7H2,1H3,(H,8,9).
What are the key properties of N-amino-N'-methylpyrrolidine-1-carboximidamide?
N-amino-N'-methylpyrrolidine-1-carboximidamide has a molecular weight of 142.21 g/mol, XLogP of -0.47, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N'-methylpyrrolidine-1-carboximidamide is sourced from PubChem (CID 89196844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).