aminomethanol;methylaminomethanol

C4H17N3O3 — CID 18952012

IUPACaminomethanol;methylaminomethanol
SMILESCNCO.NCO.NCO
InChIInChI=1S/C2H7NO.2CH5NO/c1-3-2-4;2*2-1-3/h3-4H,2H2,1H3;2*3H,1-2H2
InChIKeyFFSFUQRPLAFHKW-UHFFFAOYSA-N
MW155.20 g/mol
LogP-3.05
Rot. Bonds1

About aminomethanol;methylaminomethanol

aminomethanol;methylaminomethanol (PubChem CID 18952012) has the molecular formula C4H17N3O3 and a molecular weight of 155.20 g/mol. Its IUPAC name is aminomethanol;methylaminomethanol.

Molecular Properties

Compound Nameaminomethanol;methylaminomethanol
PubChem CID18952012
Molecular FormulaC4H17N3O3
Molecular Weight155.20 g/mol
Exact Mass155.13
IUPAC Nameaminomethanol;methylaminomethanol
SMILESCNCO.NCO.NCO
InChIInChI=1S/C2H7NO.2CH5NO/c1-3-2-4;2*2-1-3/h3-4H,2H2,1H3;2*3H,1-2H2
InChIKeyFFSFUQRPLAFHKW-UHFFFAOYSA-N
XLogP-3.05
TPSA124.76 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500155.20
LogP ≤ 5-3.05
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze aminomethanol;methylaminomethanol 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 aminomethanol;methylaminomethanol?
The IUPAC name of aminomethanol;methylaminomethanol (CID 18952012) is aminomethanol;methylaminomethanol.
What is the SMILES notation for aminomethanol;methylaminomethanol?
The canonical SMILES for aminomethanol;methylaminomethanol is CNCO.NCO.NCO.
What is the InChIKey of aminomethanol;methylaminomethanol?
The InChIKey is FFSFUQRPLAFHKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7NO.2CH5NO/c1-3-2-4;2*2-1-3/h3-4H,2H2,1H3;2*3H,1-2H2.
What are the key properties of aminomethanol;methylaminomethanol?
aminomethanol;methylaminomethanol has a molecular weight of 155.20 g/mol, XLogP of -3.05, 1 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for aminomethanol;methylaminomethanol is sourced from PubChem (CID 18952012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).