About N-amino-N-[methyl(propan-2-yl)amino]methanamine
N-amino-N-[methyl(propan-2-yl)amino]methanamine (PubChem CID 151140800) has the molecular formula C5H15N3
and a molecular weight of 117.20 g/mol. Its IUPAC name is N-amino-N-[methyl(propan-2-yl)amino]methanamine.
Molecular Properties
| Compound Name | N-amino-N-[methyl(propan-2-yl)amino]methanamine |
| PubChem CID | 151140800 |
| Molecular Formula | C5H15N3 |
| Molecular Weight | 117.20 g/mol |
| Exact Mass | 117.13 |
| IUPAC Name | N-amino-N-[methyl(propan-2-yl)amino]methanamine |
| SMILES | CC(C)N(C)N(C)N |
| InChI | InChI=1S/C5H15N3/c1-5(2)7(3)8(4)6/h5H,6H2,1-4H3 |
| InChIKey | MWDUXSCXSNYOPA-UHFFFAOYSA-N |
| XLogP | 0.05 |
| TPSA | 32.50 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 8 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 117.20 |
| LogP ≤ 5 | 0.05 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', '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-[methyl(propan-2-yl)amino]methanamine?
The IUPAC name of N-amino-N-[methyl(propan-2-yl)amino]methanamine (CID 151140800) is N-amino-N-[methyl(propan-2-yl)amino]methanamine.
What is the SMILES notation for N-amino-N-[methyl(propan-2-yl)amino]methanamine?
The canonical SMILES for N-amino-N-[methyl(propan-2-yl)amino]methanamine is CC(C)N(C)N(C)N.
What is the InChIKey of N-amino-N-[methyl(propan-2-yl)amino]methanamine?
The InChIKey is MWDUXSCXSNYOPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H15N3/c1-5(2)7(3)8(4)6/h5H,6H2,1-4H3.
What are the key properties of N-amino-N-[methyl(propan-2-yl)amino]methanamine?
N-amino-N-[methyl(propan-2-yl)amino]methanamine has a molecular weight of 117.20 g/mol, XLogP of 0.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N-[methyl(propan-2-yl)amino]methanamine is sourced from PubChem (CID 151140800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).