2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine

C11H15N3 — CID 24863780

IUPAC2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine
SMILESNC(N)=Nc1ccc2c(c1)CCCC2
InChIInChI=1S/C11H15N3/c12-11(13)14-10-6-5-8-3-1-2-4-9(8)7-10/h5-7H,1-4H2,(H4,12,13,14)
InChIKeyZFYOCHWWKWULRT-UHFFFAOYSA-N
MW189.26 g/mol
LogP1.47
Rot. Bonds1

About 2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine

2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine (PubChem CID 24863780) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine.

Molecular Properties

Compound Name2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine
PubChem CID24863780
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine
SMILESNC(N)=Nc1ccc2c(c1)CCCC2
InChIInChI=1S/C11H15N3/c12-11(13)14-10-6-5-8-3-1-2-4-9(8)7-10/h5-7H,1-4H2,(H4,12,13,14)
InChIKeyZFYOCHWWKWULRT-UHFFFAOYSA-N
XLogP1.47
TPSA64.40 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-Naphthylamine
CID 7057
1,5-Diaminonaphthalene
CID 16720
3,4-Dimethylaniline
CID 7248
2,3-Diaminonaphthalene
CID 69872
1-carbamimidamido-N-(4-methylphenyl)methanimidamide
CID 2730263
2-Naphthyl isocyanate
CID 16718
2-Naphthalenamine, hydrochloride
CID 11925
2-Naphthylisothiocyanate
CID 74222
5-Tetralinylamine
CID 16671
Guanidine, 4,4'-methylenediphenyldi-
CID 24484
2,2'-Dimethylbenzidine
CID 66537
Di-p-tolylcarbodiimide
CID 69763

Frequently Asked Questions

What is the IUPAC name of 2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine?
The IUPAC name of 2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine (CID 24863780) is 2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine.
What is the SMILES notation for 2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine?
The canonical SMILES for 2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine is NC(N)=Nc1ccc2c(c1)CCCC2.
What is the InChIKey of 2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine?
The InChIKey is ZFYOCHWWKWULRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c12-11(13)14-10-6-5-8-3-1-2-4-9(8)7-10/h5-7H,1-4H2,(H4,12,13,14).
What are the key properties of 2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine?
2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine has a molecular weight of 189.26 g/mol, XLogP of 1.47, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6,7,8-tetrahydronaphthalen-2-yl)guanidine is sourced from PubChem (CID 24863780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).