N-amino-N-(methylamino)propan-1-amine

C4H13N3 — CID 54265310

IUPACN-amino-N-(methylamino)propan-1-amine
SMILESCCCN(N)NC
InChIInChI=1S/C4H13N3/c1-3-4-7(5)6-2/h6H,3-5H2,1-2H3
InChIKeyRGILXKOKXUOUJS-UHFFFAOYSA-N
MW103.17 g/mol
LogP-0.29
Rot. Bonds3

About N-amino-N-(methylamino)propan-1-amine

N-amino-N-(methylamino)propan-1-amine (PubChem CID 54265310) has the molecular formula C4H13N3 and a molecular weight of 103.17 g/mol. Its IUPAC name is N-amino-N-(methylamino)propan-1-amine.

Molecular Properties

Compound NameN-amino-N-(methylamino)propan-1-amine
PubChem CID54265310
Molecular FormulaC4H13N3
Molecular Weight103.17 g/mol
Exact Mass103.11
IUPAC NameN-amino-N-(methylamino)propan-1-amine
SMILESCCCN(N)NC
InChIInChI=1S/C4H13N3/c1-3-4-7(5)6-2/h6H,3-5H2,1-2H3
InChIKeyRGILXKOKXUOUJS-UHFFFAOYSA-N
XLogP-0.29
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.17
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(methylamino)propan-1-amine?
The IUPAC name of N-amino-N-(methylamino)propan-1-amine (CID 54265310) is N-amino-N-(methylamino)propan-1-amine.
What is the SMILES notation for N-amino-N-(methylamino)propan-1-amine?
The canonical SMILES for N-amino-N-(methylamino)propan-1-amine is CCCN(N)NC.
What is the InChIKey of N-amino-N-(methylamino)propan-1-amine?
The InChIKey is RGILXKOKXUOUJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H13N3/c1-3-4-7(5)6-2/h6H,3-5H2,1-2H3.
What are the key properties of N-amino-N-(methylamino)propan-1-amine?
N-amino-N-(methylamino)propan-1-amine has a molecular weight of 103.17 g/mol, XLogP of -0.29, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N-(methylamino)propan-1-amine is sourced from PubChem (CID 54265310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).