2-(2,3-dihydroinden-1-ylideneamino)guanidine

C10H12N4 — CID 639266

IUPAC2-(2,3-dihydroinden-1-ylideneamino)guanidine
SMILESNC(N)=NN=C1CCc2ccccc21
InChIInChI=1S/C10H12N4/c11-10(12)14-13-9-6-5-7-3-1-2-4-8(7)9/h1-4H,5-6H2,(H4,11,12,14)
InChIKeyKQRVMHTZHXFBPI-UHFFFAOYSA-N
MW188.23 g/mol
LogP0.61
Rot. Bonds1

About 2-(2,3-dihydroinden-1-ylideneamino)guanidine

2-(2,3-dihydroinden-1-ylideneamino)guanidine (PubChem CID 639266) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-(2,3-dihydroinden-1-ylideneamino)guanidine.

Molecular Properties

Compound Name2-(2,3-dihydroinden-1-ylideneamino)guanidine
PubChem CID639266
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name2-(2,3-dihydroinden-1-ylideneamino)guanidine
SMILESNC(N)=NN=C1CCc2ccccc21
InChIInChI=1S/C10H12N4/c11-10(12)14-13-9-6-5-7-3-1-2-4-8(7)9/h1-4H,5-6H2,(H4,11,12,14)
InChIKeyKQRVMHTZHXFBPI-UHFFFAOYSA-N
XLogP0.61
TPSA76.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 50.61
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-(2,3-dihydroinden-1-ylideneamino)guanidine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydroinden-1-ylideneamino)guanidine?
The IUPAC name of 2-(2,3-dihydroinden-1-ylideneamino)guanidine (CID 639266) is 2-(2,3-dihydroinden-1-ylideneamino)guanidine.
What is the SMILES notation for 2-(2,3-dihydroinden-1-ylideneamino)guanidine?
The canonical SMILES for 2-(2,3-dihydroinden-1-ylideneamino)guanidine is NC(N)=NN=C1CCc2ccccc21.
What is the InChIKey of 2-(2,3-dihydroinden-1-ylideneamino)guanidine?
The InChIKey is KQRVMHTZHXFBPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c11-10(12)14-13-9-6-5-7-3-1-2-4-8(7)9/h1-4H,5-6H2,(H4,11,12,14).
What are the key properties of 2-(2,3-dihydroinden-1-ylideneamino)guanidine?
2-(2,3-dihydroinden-1-ylideneamino)guanidine has a molecular weight of 188.23 g/mol, XLogP of 0.61, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydroinden-1-ylideneamino)guanidine is sourced from PubChem (CID 639266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).