N',2-diethyl-5-methylpyrrolidine-1-carboximidamide

C10H21N3 — CID 83219209

IUPACN',2-diethyl-5-methylpyrrolidine-1-carboximidamide
SMILESCC/N=C(\N)N1C(C)CCC1CC
InChIInChI=1S/C10H21N3/c1-4-9-7-6-8(3)13(9)10(11)12-5-2/h8-9H,4-7H2,1-3H3,(H2,11,12)
InChIKeyYUJKOOGTBPXKSJ-UHFFFAOYSA-N
MW183.30 g/mol
LogP1.58
Rot. Bonds2

About N',2-diethyl-5-methylpyrrolidine-1-carboximidamide

N',2-diethyl-5-methylpyrrolidine-1-carboximidamide (PubChem CID 83219209) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is N',2-diethyl-5-methylpyrrolidine-1-carboximidamide.

Molecular Properties

Compound NameN',2-diethyl-5-methylpyrrolidine-1-carboximidamide
PubChem CID83219209
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC NameN',2-diethyl-5-methylpyrrolidine-1-carboximidamide
SMILESCC/N=C(\N)N1C(C)CCC1CC
InChIInChI=1S/C10H21N3/c1-4-9-7-6-8(3)13(9)10(11)12-5-2/h8-9H,4-7H2,1-3H3,(H2,11,12)
InChIKeyYUJKOOGTBPXKSJ-UHFFFAOYSA-N
XLogP1.58
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N',2-diethyl-5-methylpyrrolidine-1-carboximidamide?
The IUPAC name of N',2-diethyl-5-methylpyrrolidine-1-carboximidamide (CID 83219209) is N',2-diethyl-5-methylpyrrolidine-1-carboximidamide.
What is the SMILES notation for N',2-diethyl-5-methylpyrrolidine-1-carboximidamide?
The canonical SMILES for N',2-diethyl-5-methylpyrrolidine-1-carboximidamide is CC/N=C(\N)N1C(C)CCC1CC.
What is the InChIKey of N',2-diethyl-5-methylpyrrolidine-1-carboximidamide?
The InChIKey is YUJKOOGTBPXKSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3/c1-4-9-7-6-8(3)13(9)10(11)12-5-2/h8-9H,4-7H2,1-3H3,(H2,11,12).
What are the key properties of N',2-diethyl-5-methylpyrrolidine-1-carboximidamide?
N',2-diethyl-5-methylpyrrolidine-1-carboximidamide has a molecular weight of 183.30 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N',2-diethyl-5-methylpyrrolidine-1-carboximidamide is sourced from PubChem (CID 83219209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).