3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride

C7H17Cl2N3O — CID 137332549

IUPAC3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride
SMILESCN(C)C(=O)N1CCC(N)C1.Cl.Cl
InChIInChI=1S/C7H15N3O.2ClH/c1-9(2)7(11)10-4-3-6(8)5-10;;/h6H,3-5,8H2,1-2H3;2*1H
InChIKeyWCBUYSZBBCJKPC-UHFFFAOYSA-N
MW230.14 g/mol
LogP0.54
Rot. Bonds

About 3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride

3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride (PubChem CID 137332549) has the molecular formula C7H17Cl2N3O and a molecular weight of 230.14 g/mol. Its IUPAC name is 3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride.

Molecular Properties

Compound Name3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride
PubChem CID137332549
Molecular FormulaC7H17Cl2N3O
Molecular Weight230.14 g/mol
Exact Mass229.07
IUPAC Name3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride
SMILESCN(C)C(=O)N1CCC(N)C1.Cl.Cl
InChIInChI=1S/C7H15N3O.2ClH/c1-9(2)7(11)10-4-3-6(8)5-10;;/h6H,3-5,8H2,1-2H3;2*1H
InChIKeyWCBUYSZBBCJKPC-UHFFFAOYSA-N
XLogP0.54
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.14
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride 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 3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride?
The IUPAC name of 3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride (CID 137332549) is 3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride.
What is the SMILES notation for 3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride?
The canonical SMILES for 3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride is CN(C)C(=O)N1CCC(N)C1.Cl.Cl.
What is the InChIKey of 3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride?
The InChIKey is WCBUYSZBBCJKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O.2ClH/c1-9(2)7(11)10-4-3-6(8)5-10;;/h6H,3-5,8H2,1-2H3;2*1H.
What are the key properties of 3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride?
3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride has a molecular weight of 230.14 g/mol, XLogP of 0.54, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N,N-dimethylpyrrolidine-1-carboxamide;dihydrochloride is sourced from PubChem (CID 137332549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).