methylidyne(naphthalen-1-yl)azanium

C11H8N+ — CID 6327383

IUPACmethylidyne(naphthalen-1-yl)azanium
SMILESC#[N+]c1cccc2ccccc12
InChIInChI=1S/C11H8N/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h1-8H/q+1
InChIKeyPYBZXADBZLKEOF-UHFFFAOYSA-N
MW154.19 g/mol
LogP3.43
Rot. Bonds

About methylidyne(naphthalen-1-yl)azanium

methylidyne(naphthalen-1-yl)azanium (PubChem CID 6327383) has the molecular formula C11H8N+ and a molecular weight of 154.19 g/mol. Its IUPAC name is methylidyne(naphthalen-1-yl)azanium.

Molecular Properties

Compound Namemethylidyne(naphthalen-1-yl)azanium
PubChem CID6327383
Molecular FormulaC11H8N+
Molecular Weight154.19 g/mol
Exact Mass154.07
IUPAC Namemethylidyne(naphthalen-1-yl)azanium
SMILESC#[N+]c1cccc2ccccc12
InChIInChI=1S/C11H8N/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h1-8H/q+1
InChIKeyPYBZXADBZLKEOF-UHFFFAOYSA-N
XLogP3.43
TPSA4.36 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.19
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of methylidyne(naphthalen-1-yl)azanium?
The IUPAC name of methylidyne(naphthalen-1-yl)azanium (CID 6327383) is methylidyne(naphthalen-1-yl)azanium.
What is the SMILES notation for methylidyne(naphthalen-1-yl)azanium?
The canonical SMILES for methylidyne(naphthalen-1-yl)azanium is C#[N+]c1cccc2ccccc12.
What is the InChIKey of methylidyne(naphthalen-1-yl)azanium?
The InChIKey is PYBZXADBZLKEOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h1-8H/q+1.
What are the key properties of methylidyne(naphthalen-1-yl)azanium?
methylidyne(naphthalen-1-yl)azanium has a molecular weight of 154.19 g/mol, XLogP of 3.43, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methylidyne(naphthalen-1-yl)azanium is sourced from PubChem (CID 6327383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).