2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine

C10H14N4 — CID 5493424

IUPAC2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine
SMILESC/C(Cc1ccccc1)=N/N=C(N)N
InChIInChI=1S/C10H14N4/c1-8(13-14-10(11)12)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H4,11,12,14)/b13-8-
InChIKeyPOWVVNLOEVCJBK-JYRVWZFOSA-N
MW190.25 g/mol
LogP0.88
Rot. Bonds3

About 2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine

2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine (PubChem CID 5493424) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine.

Molecular Properties

Compound Name2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine
PubChem CID5493424
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine
SMILESC/C(Cc1ccccc1)=N/N=C(N)N
InChIInChI=1S/C10H14N4/c1-8(13-14-10(11)12)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H4,11,12,14)/b13-8-
InChIKeyPOWVVNLOEVCJBK-JYRVWZFOSA-N
XLogP0.88
TPSA76.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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

2-[(Z)-1-(3-fluorophenyl)propan-2-ylideneamino]guanidine
CID 115694674
(E)-1-phenylpropan-2-ylidenehydrazine
CID 15578189
2-(1,2-diphenylethylideneamino)guanidine
CID 77060183
(Z)-2-(1-phenylpropan-2-ylideneamino)ethenamine
CID 143649940
1,4-diphenylbut-2-ene-2,3-diamine
CID 67744417
(E)-N-methyliminoboranyl-1-phenylpropan-2-imine
CID 143866927
methanol;1-[4-[(2E)-2-[(E)-1-phenylethylidenehydrazinylidene]propyl]phenyl]ethanone
CID 142452212
1-phenylbut-2-en-2-amine
CID 68995045
N'-hydroxy-2-phenylethanimidamide
CID 6074309
(E)-N-tert-butylsulfanyl-1-phenylpropan-2-imine
CID 130421182
2-(1-phenylbutylideneamino)guanidine
CID 76872532
acetic acid;2-oxo-3-phenylpropanamide
CID 143555968

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine?
The IUPAC name of 2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine (CID 5493424) is 2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine.
What is the SMILES notation for 2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine?
The canonical SMILES for 2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine is C/C(Cc1ccccc1)=N/N=C(N)N.
What is the InChIKey of 2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine?
The InChIKey is POWVVNLOEVCJBK-JYRVWZFOSA-N. The full InChI is InChI=1S/C10H14N4/c1-8(13-14-10(11)12)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H4,11,12,14)/b13-8-.
What are the key properties of 2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine?
2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine has a molecular weight of 190.25 g/mol, XLogP of 0.88, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-1-phenylpropan-2-ylideneamino]guanidine is sourced from PubChem (CID 5493424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).