1-methylnaphthalen-2-amine;hydrochloride

C11H12ClN — CID 67212687

IUPAC1-methylnaphthalen-2-amine;hydrochloride
SMILESCc1c(N)ccc2ccccc12.Cl
InChIInChI=1S/C11H11N.ClH/c1-8-10-5-3-2-4-9(10)6-7-11(8)12;/h2-7H,12H2,1H3;1H
InChIKeyOWWHAWFUFLZZHN-UHFFFAOYSA-N
MW193.68 g/mol
LogP3.15
Rot. Bonds

About 1-methylnaphthalen-2-amine;hydrochloride

1-methylnaphthalen-2-amine;hydrochloride (PubChem CID 67212687) has the molecular formula C11H12ClN and a molecular weight of 193.68 g/mol. Its IUPAC name is 1-methylnaphthalen-2-amine;hydrochloride.

Molecular Properties

Compound Name1-methylnaphthalen-2-amine;hydrochloride
PubChem CID67212687
Molecular FormulaC11H12ClN
Molecular Weight193.68 g/mol
Exact Mass193.07
IUPAC Name1-methylnaphthalen-2-amine;hydrochloride
SMILESCc1c(N)ccc2ccccc12.Cl
InChIInChI=1S/C11H11N.ClH/c1-8-10-5-3-2-4-9(10)6-7-11(8)12;/h2-7H,12H2,1H3;1H
InChIKeyOWWHAWFUFLZZHN-UHFFFAOYSA-N
XLogP3.15
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.68
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methylnaphthalen-2-amine;hydrochloride?
The IUPAC name of 1-methylnaphthalen-2-amine;hydrochloride (CID 67212687) is 1-methylnaphthalen-2-amine;hydrochloride.
What is the SMILES notation for 1-methylnaphthalen-2-amine;hydrochloride?
The canonical SMILES for 1-methylnaphthalen-2-amine;hydrochloride is Cc1c(N)ccc2ccccc12.Cl.
What is the InChIKey of 1-methylnaphthalen-2-amine;hydrochloride?
The InChIKey is OWWHAWFUFLZZHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N.ClH/c1-8-10-5-3-2-4-9(10)6-7-11(8)12;/h2-7H,12H2,1H3;1H.
What are the key properties of 1-methylnaphthalen-2-amine;hydrochloride?
1-methylnaphthalen-2-amine;hydrochloride has a molecular weight of 193.68 g/mol, XLogP of 3.15, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylnaphthalen-2-amine;hydrochloride is sourced from PubChem (CID 67212687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).