N,N-dimethyl-8-phenylseleninylnaphthalen-1-amine

C18H17NOSe — CID 15456274

IUPACN,N-dimethyl-8-phenylseleninylnaphthalen-1-amine
SMILESCN(C)c1cccc2cccc([Se](=O)c3ccccc3)c12
InChIInChI=1S/C18H17NOSe/c1-19(2)16-12-6-8-14-9-7-13-17(18(14)16)21(20)15-10-4-3-5-11-15/h3-13H,1-2H3
InChIKeyLUEUAZKHTDURKF-UHFFFAOYSA-N
MW342.30 g/mol
LogP2.44
Rot. Bonds3

About N,N-dimethyl-8-phenylseleninylnaphthalen-1-amine

N,N-dimethyl-8-phenylseleninylnaphthalen-1-amine (PubChem CID 15456274) has the molecular formula C18H17NOSe and a molecular weight of 342.30 g/mol. Its IUPAC name is N,N-dimethyl-8-phenylseleninylnaphthalen-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-8-phenylseleninylnaphthalen-1-amine
PubChem CID15456274
Molecular FormulaC18H17NOSe
Molecular Weight342.30 g/mol
Exact Mass343.05
IUPAC NameN,N-dimethyl-8-phenylseleninylnaphthalen-1-amine
SMILESCN(C)c1cccc2cccc([Se](=O)c3ccccc3)c12
InChIInChI=1S/C18H17NOSe/c1-19(2)16-12-6-8-14-9-7-13-17(18(14)16)21(20)15-10-4-3-5-11-15/h3-13H,1-2H3
InChIKeyLUEUAZKHTDURKF-UHFFFAOYSA-N
XLogP2.44
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.30
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-phenylseleninylnaphthalene
CID 11844373
1-N-[[2-[[[8-(dimethylamino)naphthalen-1-yl]-methylamino]methyl]phenyl]methyl]-1-N,8-N,8-N-trimethylnaphthalene-1,8-diamine
CID 155936920
N,N-dimethylnaphthalen-1-amine;hydroxylamine
CID 135773162
[8-(dimethylamino)naphthalen-1-yl]tellanyllithium
CID 140734839
8-[fluoro-methyl-[methyl(diphenyl)silyl]silyl]-N,N-dimethylnaphthalen-1-amine
CID 101142420
[8-(dimethylamino)naphthalen-1-yl] dimethyl phosphate
CID 71421993
bis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide
CID 139159619
N,N,1-trimethylbenzo[g]indol-9-amine
CID 91691308
8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine
CID 101153069
N,N-dimethylnaphthalen-1-amine;sulfuric acid
CID 159908177
2-[[8-(dimethylamino)isoquinolin-1-yl]-methylamino]acetic acid
CID 82572831
8-[dichloro(ethyl)silyl]-N,N-dimethylnaphthalen-1-amine
CID 101060213

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-8-phenylseleninylnaphthalen-1-amine?
The IUPAC name of N,N-dimethyl-8-phenylseleninylnaphthalen-1-amine (CID 15456274) is N,N-dimethyl-8-phenylseleninylnaphthalen-1-amine.
What is the SMILES notation for N,N-dimethyl-8-phenylseleninylnaphthalen-1-amine?
The canonical SMILES for N,N-dimethyl-8-phenylseleninylnaphthalen-1-amine is CN(C)c1cccc2cccc([Se](=O)c3ccccc3)c12.
What is the InChIKey of N,N-dimethyl-8-phenylseleninylnaphthalen-1-amine?
The InChIKey is LUEUAZKHTDURKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NOSe/c1-19(2)16-12-6-8-14-9-7-13-17(18(14)16)21(20)15-10-4-3-5-11-15/h3-13H,1-2H3.
What are the key properties of N,N-dimethyl-8-phenylseleninylnaphthalen-1-amine?
N,N-dimethyl-8-phenylseleninylnaphthalen-1-amine has a molecular weight of 342.30 g/mol, XLogP of 2.44, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-8-phenylseleninylnaphthalen-1-amine is sourced from PubChem (CID 15456274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).