N,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide

C11H23N3 — CID 14423431

IUPACN,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide
SMILESCC(C)/N=C(/NC(C)C)N1CCCC1
InChIInChI=1S/C11H23N3/c1-9(2)12-11(13-10(3)4)14-7-5-6-8-14/h9-10H,5-8H2,1-4H3,(H,12,13)
InChIKeyQNKWRUWWMNOUAK-UHFFFAOYSA-N
MW197.33 g/mol
LogP1.84
Rot. Bonds2

About N,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide

N,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide (PubChem CID 14423431) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is N,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide.

Molecular Properties

Compound NameN,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide
PubChem CID14423431
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC NameN,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide
SMILESCC(C)/N=C(/NC(C)C)N1CCCC1
InChIInChI=1S/C11H23N3/c1-9(2)12-11(13-10(3)4)14-7-5-6-8-14/h9-10H,5-8H2,1-4H3,(H,12,13)
InChIKeyQNKWRUWWMNOUAK-UHFFFAOYSA-N
XLogP1.84
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 51.84
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'}

Analyze N,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide?
The IUPAC name of N,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide (CID 14423431) is N,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide.
What is the SMILES notation for N,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide?
The canonical SMILES for N,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide is CC(C)/N=C(/NC(C)C)N1CCCC1.
What is the InChIKey of N,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide?
The InChIKey is QNKWRUWWMNOUAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-9(2)12-11(13-10(3)4)14-7-5-6-8-14/h9-10H,5-8H2,1-4H3,(H,12,13).
What are the key properties of N,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide?
N,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide has a molecular weight of 197.33 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-di(propan-2-yl)pyrrolidine-1-carboximidamide is sourced from PubChem (CID 14423431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).