N'-amino-N-[(Z)-propylideneamino]methanimidamide

C4H10N4 — CID 123771681

IUPACN'-amino-N-[(Z)-propylideneamino]methanimidamide
SMILESCC/C=N\N/C=N/N
InChIInChI=1S/C4H10N4/c1-2-3-7-8-4-6-5/h3-4H,2,5H2,1H3,(H,6,8)/b7-3-
InChIKeyCRHJWKIPHXJUJY-CLTKARDFSA-N
MW114.15 g/mol
LogP-0.13
Rot. Bonds3

About N'-amino-N-[(Z)-propylideneamino]methanimidamide

N'-amino-N-[(Z)-propylideneamino]methanimidamide (PubChem CID 123771681) has the molecular formula C4H10N4 and a molecular weight of 114.15 g/mol. Its IUPAC name is N'-amino-N-[(Z)-propylideneamino]methanimidamide.

Molecular Properties

Compound NameN'-amino-N-[(Z)-propylideneamino]methanimidamide
PubChem CID123771681
Molecular FormulaC4H10N4
Molecular Weight114.15 g/mol
Exact Mass114.09
IUPAC NameN'-amino-N-[(Z)-propylideneamino]methanimidamide
SMILESCC/C=N\N/C=N/N
InChIInChI=1S/C4H10N4/c1-2-3-7-8-4-6-5/h3-4H,2,5H2,1H3,(H,6,8)/b7-3-
InChIKeyCRHJWKIPHXJUJY-CLTKARDFSA-N
XLogP-0.13
TPSA62.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.15
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Propanal, methylhydrazone
CID 266161
Isobutyraldehyde methylhydrazone
CID 567578
Propionaldehyde, ethylhydrazone
CID 9570256
(1E)-Propanal ethylhydrazone
CID 23903
Propionaldehyde n-propyl hydrazone
CID 140574
Propanal, propylhydrazone
CID 9576975
(2Z)-1-Methyl-2-propylidenehydrazine
CID 6372318
Butyraldehyde ethylhydrazone
CID 533865
Propanal, 2-methyl-, methylhydrazone
CID 9602439
Butanal, ethylhydrazone
CID 9601342
N-[(Z)-propylideneamino]propan-1-amine
CID 5367909
2-Methylpropanal methyl hydrazone
CID 5369231

Frequently Asked Questions

What is the IUPAC name of N'-amino-N-[(Z)-propylideneamino]methanimidamide?
The IUPAC name of N'-amino-N-[(Z)-propylideneamino]methanimidamide (CID 123771681) is N'-amino-N-[(Z)-propylideneamino]methanimidamide.
What is the SMILES notation for N'-amino-N-[(Z)-propylideneamino]methanimidamide?
The canonical SMILES for N'-amino-N-[(Z)-propylideneamino]methanimidamide is CC/C=N\N/C=N/N.
What is the InChIKey of N'-amino-N-[(Z)-propylideneamino]methanimidamide?
The InChIKey is CRHJWKIPHXJUJY-CLTKARDFSA-N. The full InChI is InChI=1S/C4H10N4/c1-2-3-7-8-4-6-5/h3-4H,2,5H2,1H3,(H,6,8)/b7-3-.
What are the key properties of N'-amino-N-[(Z)-propylideneamino]methanimidamide?
N'-amino-N-[(Z)-propylideneamino]methanimidamide has a molecular weight of 114.15 g/mol, XLogP of -0.13, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-amino-N-[(Z)-propylideneamino]methanimidamide is sourced from PubChem (CID 123771681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).