naphthalen-1-amine;2-phenylethanamine

C18H20N2 — CID 175144092

IUPACnaphthalen-1-amine;2-phenylethanamine
SMILESNCCc1ccccc1.Nc1cccc2ccccc12
InChIInChI=1S/C10H9N.C8H11N/c11-10-7-3-5-8-4-1-2-6-9(8)10;9-7-6-8-4-2-1-3-5-8/h1-7H,11H2;1-5H,6-7,9H2
InChIKeyIREKHRPZQJBTJE-UHFFFAOYSA-N
MW264.37 g/mol
LogP3.61
Rot. Bonds2

About naphthalen-1-amine;2-phenylethanamine

naphthalen-1-amine;2-phenylethanamine (PubChem CID 175144092) has the molecular formula C18H20N2 and a molecular weight of 264.37 g/mol. Its IUPAC name is naphthalen-1-amine;2-phenylethanamine.

Molecular Properties

Compound Namenaphthalen-1-amine;2-phenylethanamine
PubChem CID175144092
Molecular FormulaC18H20N2
Molecular Weight264.37 g/mol
Exact Mass264.16
IUPAC Namenaphthalen-1-amine;2-phenylethanamine
SMILESNCCc1ccccc1.Nc1cccc2ccccc12
InChIInChI=1S/C10H9N.C8H11N/c11-10-7-3-5-8-4-1-2-6-9(8)10;9-7-6-8-4-2-1-3-5-8/h1-7H,11H2;1-5H,6-7,9H2
InChIKeyIREKHRPZQJBTJE-UHFFFAOYSA-N
XLogP3.61
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

naphthalen-1-amine;phenylmethanamine
CID 23298608
CID 135259743
CID 135259743
azane;naphthalen-1-amine;dihydrochloride
CID 142719941
azane;2-phenylethanamine
CID 23506485
dichloromethane;naphthalen-1-amine
CID 174958204
2-[4-(2-phenylethyl)phenyl]ethanamine
CID 15036636
diphenyldiazene;naphthalen-1-amine
CID 159387194
diazene;naphthalen-1-amine
CID 142081772
naphthalen-1-amine;1,3,5,2,4,6-triazatriphosphinane
CID 175083244
naphthalen-1-amine;naphthalen-2-amine
CID 70377972
formic acid;naphthalen-1-amine
CID 174286759
methylsulfonylmethane;naphthalen-1-amine
CID 158608928

Frequently Asked Questions

What is the IUPAC name of naphthalen-1-amine;2-phenylethanamine?
The IUPAC name of naphthalen-1-amine;2-phenylethanamine (CID 175144092) is naphthalen-1-amine;2-phenylethanamine.
What is the SMILES notation for naphthalen-1-amine;2-phenylethanamine?
The canonical SMILES for naphthalen-1-amine;2-phenylethanamine is NCCc1ccccc1.Nc1cccc2ccccc12.
What is the InChIKey of naphthalen-1-amine;2-phenylethanamine?
The InChIKey is IREKHRPZQJBTJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N.C8H11N/c11-10-7-3-5-8-4-1-2-6-9(8)10;9-7-6-8-4-2-1-3-5-8/h1-7H,11H2;1-5H,6-7,9H2.
What are the key properties of naphthalen-1-amine;2-phenylethanamine?
naphthalen-1-amine;2-phenylethanamine has a molecular weight of 264.37 g/mol, XLogP of 3.61, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalen-1-amine;2-phenylethanamine is sourced from PubChem (CID 175144092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).