2-[(methylideneamino)hydrazinylidene]propane

C4H9N3 — CID 145419636

IUPAC2-[(methylideneamino)hydrazinylidene]propane
SMILESC=NNN=C(C)C
InChIInChI=1S/C4H9N3/c1-4(2)6-7-5-3/h7H,3H2,1-2H3
InChIKeyUOSAGIPSHUPCGO-UHFFFAOYSA-N
MW99.14 g/mol
LogP0.59
Rot. Bonds2

About 2-[(methylideneamino)hydrazinylidene]propane

2-[(methylideneamino)hydrazinylidene]propane (PubChem CID 145419636) has the molecular formula C4H9N3 and a molecular weight of 99.14 g/mol. Its IUPAC name is 2-[(methylideneamino)hydrazinylidene]propane.

Molecular Properties

Compound Name2-[(methylideneamino)hydrazinylidene]propane
PubChem CID145419636
Molecular FormulaC4H9N3
Molecular Weight99.14 g/mol
Exact Mass99.08
IUPAC Name2-[(methylideneamino)hydrazinylidene]propane
SMILESC=NNN=C(C)C
InChIInChI=1S/C4H9N3/c1-4(2)6-7-5-3/h7H,3H2,1-2H3
InChIKeyUOSAGIPSHUPCGO-UHFFFAOYSA-N
XLogP0.59
TPSA36.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.14
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2-methylidenehydrazinyl)guanidine
CID 89272404
N'-(2-methylidenehydrazinyl)-2-propan-2-yloxyethanimidamide
CID 172989590
N-(methylideneamino)prop-1-en-2-amine
CID 58051997
N'-(methylamino)-N-(methylideneamino)ethanimidamide
CID 91523915
N'-(methylamino)-N-(methylideneamino)ethanimidamide
CID 126725146
sodium N-propan-2-ylidenehydroxylamine
CID 19068199
N-(methylideneamino)prop-1-en-2-amine;molecular hydrogen
CID 155726911
N-(propan-2-ylideneamino)formamide
CID 3838852
2-[[methyl(oxido)amino]hydrazinylidene]propane
CID 163794355
3-(2-methylidenehydrazinyl)but-3-en-2-one
CID 163670052
N'-methyl-N-(propan-2-ylideneamino)methanimidamide
CID 129046835
(propan-2-ylideneamino)urea;sulfane;urea
CID 174867107

Frequently Asked Questions

What is the IUPAC name of 2-[(methylideneamino)hydrazinylidene]propane?
The IUPAC name of 2-[(methylideneamino)hydrazinylidene]propane (CID 145419636) is 2-[(methylideneamino)hydrazinylidene]propane.
What is the SMILES notation for 2-[(methylideneamino)hydrazinylidene]propane?
The canonical SMILES for 2-[(methylideneamino)hydrazinylidene]propane is C=NNN=C(C)C.
What is the InChIKey of 2-[(methylideneamino)hydrazinylidene]propane?
The InChIKey is UOSAGIPSHUPCGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N3/c1-4(2)6-7-5-3/h7H,3H2,1-2H3.
What are the key properties of 2-[(methylideneamino)hydrazinylidene]propane?
2-[(methylideneamino)hydrazinylidene]propane has a molecular weight of 99.14 g/mol, XLogP of 0.59, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(methylideneamino)hydrazinylidene]propane is sourced from PubChem (CID 145419636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).