naphthalen-1-amine;naphthalen-2-amine

C20H18N2 — CID 70377972

IUPACnaphthalen-1-amine;naphthalen-2-amine
SMILESNc1ccc2ccccc2c1.Nc1cccc2ccccc12
InChIInChI=1S/2C10H9N/c11-10-7-3-5-8-4-1-2-6-9(8)10;11-10-6-5-8-3-1-2-4-9(8)7-10/h2*1-7H,11H2
InChIKeyKLYWOECPXNAJPC-UHFFFAOYSA-N
MW286.38 g/mol
LogP4.84
Rot. Bonds

About naphthalen-1-amine;naphthalen-2-amine

naphthalen-1-amine;naphthalen-2-amine (PubChem CID 70377972) has the molecular formula C20H18N2 and a molecular weight of 286.38 g/mol. Its IUPAC name is naphthalen-1-amine;naphthalen-2-amine.

Molecular Properties

Compound Namenaphthalen-1-amine;naphthalen-2-amine
PubChem CID70377972
Molecular FormulaC20H18N2
Molecular Weight286.38 g/mol
Exact Mass286.15
IUPAC Namenaphthalen-1-amine;naphthalen-2-amine
SMILESNc1ccc2ccccc2c1.Nc1cccc2ccccc12
InChIInChI=1S/2C10H9N/c11-10-7-3-5-8-4-1-2-6-9(8)10;11-10-6-5-8-3-1-2-4-9(8)7-10/h2*1-7H,11H2
InChIKeyKLYWOECPXNAJPC-UHFFFAOYSA-N
XLogP4.84
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 54.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of naphthalen-1-amine;naphthalen-2-amine?
The IUPAC name of naphthalen-1-amine;naphthalen-2-amine (CID 70377972) is naphthalen-1-amine;naphthalen-2-amine.
What is the SMILES notation for naphthalen-1-amine;naphthalen-2-amine?
The canonical SMILES for naphthalen-1-amine;naphthalen-2-amine is Nc1ccc2ccccc2c1.Nc1cccc2ccccc12.
What is the InChIKey of naphthalen-1-amine;naphthalen-2-amine?
The InChIKey is KLYWOECPXNAJPC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H9N/c11-10-7-3-5-8-4-1-2-6-9(8)10;11-10-6-5-8-3-1-2-4-9(8)7-10/h2*1-7H,11H2.
What are the key properties of naphthalen-1-amine;naphthalen-2-amine?
naphthalen-1-amine;naphthalen-2-amine has a molecular weight of 286.38 g/mol, XLogP of 4.84, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalen-1-amine;naphthalen-2-amine is sourced from PubChem (CID 70377972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).