3-(methylamino)propanehydrazide

C4H11N3O — CID 59203678

IUPAC3-(methylamino)propanehydrazide
SMILESCNCCC(=O)NN
InChIInChI=1S/C4H11N3O/c1-6-3-2-4(8)7-5/h6H,2-3,5H2,1H3,(H,7,8)
InChIKeyCPYMAHWEWXBGGY-UHFFFAOYSA-N
MW117.15 g/mol
LogP-1.41
Rot. Bonds3

About 3-(methylamino)propanehydrazide

3-(methylamino)propanehydrazide (PubChem CID 59203678) has the molecular formula C4H11N3O and a molecular weight of 117.15 g/mol. Its IUPAC name is 3-(methylamino)propanehydrazide.

Molecular Properties

Compound Name3-(methylamino)propanehydrazide
PubChem CID59203678
Molecular FormulaC4H11N3O
Molecular Weight117.15 g/mol
Exact Mass117.09
IUPAC Name3-(methylamino)propanehydrazide
SMILESCNCCC(=O)NN
InChIInChI=1S/C4H11N3O/c1-6-3-2-4(8)7-5/h6H,2-3,5H2,1H3,(H,7,8)
InChIKeyCPYMAHWEWXBGGY-UHFFFAOYSA-N
XLogP-1.41
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.15
LogP ≤ 5-1.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-(methylamino)-N-[2-(methylamino)ethyl]propanamide
CID 59688102
butanedihydrazide;hydrochloride
CID 54607274
2-[2-(methylamino)ethylamino]acetohydrazide
CID 148941784
2-(methylamino)acetohydrazide
CID 22479968
hexanedihydrazide;pentanedihydrazide
CID 157195533
ethyl 3-(methylamino)propanoate;methane
CID 159702101
3-(methylamino)propanoyl chloride
CID 21027253
3-(methylamino)propanethioic S-acid
CID 90252515
3-trimethylstannylpropanehydrazide
CID 12901376
5-oxohexanehydrazide
CID 126993835
dimethyl-[2-[3-(methylamino)propanoylamino]ethyl]azanium
CID 142404926
N-(2-methoxyethyl)-3-(methylamino)propanamide
CID 43827811

Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)propanehydrazide?
The IUPAC name of 3-(methylamino)propanehydrazide (CID 59203678) is 3-(methylamino)propanehydrazide.
What is the SMILES notation for 3-(methylamino)propanehydrazide?
The canonical SMILES for 3-(methylamino)propanehydrazide is CNCCC(=O)NN.
What is the InChIKey of 3-(methylamino)propanehydrazide?
The InChIKey is CPYMAHWEWXBGGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N3O/c1-6-3-2-4(8)7-5/h6H,2-3,5H2,1H3,(H,7,8).
What are the key properties of 3-(methylamino)propanehydrazide?
3-(methylamino)propanehydrazide has a molecular weight of 117.15 g/mol, XLogP of -1.41, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)propanehydrazide is sourced from PubChem (CID 59203678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).