phenylmethanamine;hydrochloride

C7H10ClN — CID 2724127

IUPACphenylmethanamine;hydrochloride
SMILESCl.NCc1ccccc1
InChIInChI=1S/C7H9N.ClH/c8-6-7-4-2-1-3-5-7;/h1-5H,6,8H2;1H
InChIKeyXKXHCNPAFAXVRZ-UHFFFAOYSA-N
MW143.62 g/mol
LogP1.57
Rot. Bonds1

About phenylmethanamine;hydrochloride

phenylmethanamine;hydrochloride (PubChem CID 2724127) has the molecular formula C7H10ClN and a molecular weight of 143.62 g/mol. Its IUPAC name is phenylmethanamine;hydrochloride.

Molecular Properties

Compound Namephenylmethanamine;hydrochloride
PubChem CID2724127
Molecular FormulaC7H10ClN
Molecular Weight143.62 g/mol
Exact Mass143.05
IUPAC Namephenylmethanamine;hydrochloride
SMILESCl.NCc1ccccc1
InChIInChI=1S/C7H9N.ClH/c8-6-7-4-2-1-3-5-7;/h1-5H,6,8H2;1H
InChIKeyXKXHCNPAFAXVRZ-UHFFFAOYSA-N
XLogP1.57
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.62
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of phenylmethanamine;hydrochloride?
The IUPAC name of phenylmethanamine;hydrochloride (CID 2724127) is phenylmethanamine;hydrochloride.
What is the SMILES notation for phenylmethanamine;hydrochloride?
The canonical SMILES for phenylmethanamine;hydrochloride is Cl.NCc1ccccc1.
What is the InChIKey of phenylmethanamine;hydrochloride?
The InChIKey is XKXHCNPAFAXVRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N.ClH/c8-6-7-4-2-1-3-5-7;/h1-5H,6,8H2;1H.
What are the key properties of phenylmethanamine;hydrochloride?
phenylmethanamine;hydrochloride has a molecular weight of 143.62 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenylmethanamine;hydrochloride is sourced from PubChem (CID 2724127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).