1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride

C11H15ClN2 — CID 71755662

IUPAC1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)C1CCCc2ccccc21
InChIInChI=1S/C11H14N2.ClH/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10;/h1-2,4,6,10H,3,5,7H2,(H3,12,13);1H
InChIKeyGRWJGHPPVNBLJL-UHFFFAOYSA-N
MW210.71 g/mol
LogP2.46
Rot. Bonds1

About 1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride

1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride (PubChem CID 71755662) has the molecular formula C11H15ClN2 and a molecular weight of 210.71 g/mol. Its IUPAC name is 1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride.

Molecular Properties

Compound Name1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride
PubChem CID71755662
Molecular FormulaC11H15ClN2
Molecular Weight210.71 g/mol
Exact Mass210.09
IUPAC Name1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)C1CCCc2ccccc21
InChIInChI=1S/C11H14N2.ClH/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10;/h1-2,4,6,10H,3,5,7H2,(H3,12,13);1H
InChIKeyGRWJGHPPVNBLJL-UHFFFAOYSA-N
XLogP2.46
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.71
LogP ≤ 52.46
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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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride?
The IUPAC name of 1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride (CID 71755662) is 1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride.
What is the SMILES notation for 1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride?
The canonical SMILES for 1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride is Cl.[H]/N=C(\N)C1CCCc2ccccc21.
What is the InChIKey of 1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride?
The InChIKey is GRWJGHPPVNBLJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2.ClH/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10;/h1-2,4,6,10H,3,5,7H2,(H3,12,13);1H.
What are the key properties of 1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride?
1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride has a molecular weight of 210.71 g/mol, XLogP of 2.46, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4-tetrahydronaphthalene-1-carboximidamide;hydrochloride is sourced from PubChem (CID 71755662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).