2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine

C9H10Cl2N4 — CID 140896130

IUPAC2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine
SMILESNC(N)=NN=CCc1c(Cl)cccc1Cl
InChIInChI=1S/C9H10Cl2N4/c10-7-2-1-3-8(11)6(7)4-5-14-15-9(12)13/h1-3,5H,4H2,(H4,12,13,15)
InChIKeyDVSFVBPWRRXFDN-UHFFFAOYSA-N
MW245.11 g/mol
LogP1.80
Rot. Bonds3

About 2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine

2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine (PubChem CID 140896130) has the molecular formula C9H10Cl2N4 and a molecular weight of 245.11 g/mol. Its IUPAC name is 2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine.

Molecular Properties

Compound Name2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine
PubChem CID140896130
Molecular FormulaC9H10Cl2N4
Molecular Weight245.11 g/mol
Exact Mass244.03
IUPAC Name2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine
SMILESNC(N)=NN=CCc1c(Cl)cccc1Cl
InChIInChI=1S/C9H10Cl2N4/c10-7-2-1-3-8(11)6(7)4-5-14-15-9(12)13/h1-3,5H,4H2,(H4,12,13,15)
InChIKeyDVSFVBPWRRXFDN-UHFFFAOYSA-N
XLogP1.80
TPSA76.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.11
LogP ≤ 51.80
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'}

Analyze 2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-(4-hydroxyphenyl)ethylideneamino]guanidine;hydrochloride
CID 76547169
2-[2-(3,4-dihydroxyphenyl)ethylideneamino]guanidine
CID 58854562
2-[2-(2,6-dichlorophenyl)ethyl]guanidine;hydroiodide
CID 51131579
2-[(E)-[4-[(2,6-dichlorophenyl)methoxy]-3-methoxyphenyl]methylideneamino]guanidine
CID 110338402
2-[(3-chloro-2-methylsulfanylphenyl)methylideneamino]guanidine
CID 68790902
2-(3-phenylpropylideneamino)guanidine
CID 5053229
N-[bis(15N)(azanyl)(113C)methylidene]-2-(2,6-dichlorophenyl)acetamide
CID 171391513
N'-amino-2-(2,6-dichlorophenyl)ethanimidamide
CID 76923044
2-(2,6-dichlorophenyl)ethanimine
CID 57206389
2-[(E)-[4-[(2-chloro-6-fluorophenyl)methoxy]-3-methoxyphenyl]methylideneamino]guanidine
CID 110339029
2-(2,6-dichlorophenyl)ethanimidamide chloride
CID 45108783
[3-chloro-2-[(E)-(diaminomethylidenehydrazinylidene)methyl]phenyl] acetate
CID 146217397

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine?
The IUPAC name of 2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine (CID 140896130) is 2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine.
What is the SMILES notation for 2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine?
The canonical SMILES for 2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine is NC(N)=NN=CCc1c(Cl)cccc1Cl.
What is the InChIKey of 2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine?
The InChIKey is DVSFVBPWRRXFDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10Cl2N4/c10-7-2-1-3-8(11)6(7)4-5-14-15-9(12)13/h1-3,5H,4H2,(H4,12,13,15).
What are the key properties of 2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine?
2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine has a molecular weight of 245.11 g/mol, XLogP of 1.80, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2,6-dichlorophenyl)ethylideneamino]guanidine is sourced from PubChem (CID 140896130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).