3-(dimethylamino)propanimidamide

C5H13N3 — CID 3307867

IUPAC3-(dimethylamino)propanimidamide
SMILES[H]/N=C(\N)CCN(C)C
InChIInChI=1S/C5H13N3/c1-8(2)4-3-5(6)7/h3-4H2,1-2H3,(H3,6,7)
InChIKeyLIYWOKKWHOKFBA-UHFFFAOYSA-N
MW115.18 g/mol
LogP-0.13
Rot. Bonds3

About 3-(dimethylamino)propanimidamide

3-(dimethylamino)propanimidamide (PubChem CID 3307867) has the molecular formula C5H13N3 and a molecular weight of 115.18 g/mol. Its IUPAC name is 3-(dimethylamino)propanimidamide.

Molecular Properties

Compound Name3-(dimethylamino)propanimidamide
PubChem CID3307867
Molecular FormulaC5H13N3
Molecular Weight115.18 g/mol
Exact Mass115.11
IUPAC Name3-(dimethylamino)propanimidamide
SMILES[H]/N=C(\N)CCN(C)C
InChIInChI=1S/C5H13N3/c1-8(2)4-3-5(6)7/h3-4H2,1-2H3,(H3,6,7)
InChIKeyLIYWOKKWHOKFBA-UHFFFAOYSA-N
XLogP-0.13
TPSA53.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-(dimethylamino)propanimidamide 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-(dimethylamino)propanimidamide?
The IUPAC name of 3-(dimethylamino)propanimidamide (CID 3307867) is 3-(dimethylamino)propanimidamide.
What is the SMILES notation for 3-(dimethylamino)propanimidamide?
The canonical SMILES for 3-(dimethylamino)propanimidamide is [H]/N=C(\N)CCN(C)C.
What is the InChIKey of 3-(dimethylamino)propanimidamide?
The InChIKey is LIYWOKKWHOKFBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N3/c1-8(2)4-3-5(6)7/h3-4H2,1-2H3,(H3,6,7).
What are the key properties of 3-(dimethylamino)propanimidamide?
3-(dimethylamino)propanimidamide has a molecular weight of 115.18 g/mol, XLogP of -0.13, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)propanimidamide is sourced from PubChem (CID 3307867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).