8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine

C28H26N2Si — CID 101153069

IUPAC8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine
SMILESC#C[Si](C#C)(c1cccc2cccc(N(C)C)c12)c1cccc2cccc(N(C)C)c12
InChIInChI=1S/C28H26N2Si/c1-7-31(8-2,25-19-11-15-21-13-9-17-23(27(21)25)29(3)4)26-20-12-16-22-14-10-18-24(28(22)26)30(5)6/h1-2,9-20H,3-6H3
InChIKeyWFBUEBGXROPSKB-UHFFFAOYSA-N
MW418.62 g/mol
LogP4.03
Rot. Bonds4

About 8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine

8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine (PubChem CID 101153069) has the molecular formula C28H26N2Si and a molecular weight of 418.62 g/mol. Its IUPAC name is 8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine.

Molecular Properties

Compound Name8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine
PubChem CID101153069
Molecular FormulaC28H26N2Si
Molecular Weight418.62 g/mol
Exact Mass418.19
IUPAC Name8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine
SMILESC#C[Si](C#C)(c1cccc2cccc(N(C)C)c12)c1cccc2cccc(N(C)C)c12
InChIInChI=1S/C28H26N2Si/c1-7-31(8-2,25-19-11-15-21-13-9-17-23(27(21)25)29(3)4)26-20-12-16-22-14-10-18-24(28(22)26)30(5)6/h1-2,9-20H,3-6H3
InChIKeyWFBUEBGXROPSKB-UHFFFAOYSA-N
XLogP4.03
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.62
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

8-[2-[10-[2-[2-[10-[2-[2-[10-[2-[bis[8-(dimethylamino)naphthalen-1-yl]-ethynylsilyl]ethynyl]anthracen-9-yl]ethynyl-bis[8-(dimethylamino)naphthalen-1-yl]silyl]ethynyl]anthracen-9-yl]ethynyl-bis[8-(dimethylamino)naphthalen-1-yl]silyl]ethynyl]anthracen-9-yl]ethynyl-[8-(dimethylamino)naphthalen-1-yl]-ethynylsilyl]-N,N-dimethylnaphthalen-1-amine
CID 101044581
8-[dichloro(ethyl)silyl]-N,N-dimethylnaphthalen-1-amine
CID 101060213
8-[fluoro-methyl-[methyl(diphenyl)silyl]silyl]-N,N-dimethylnaphthalen-1-amine
CID 101142420
[8-(dimethylamino)naphthalen-1-yl]tellanyllithium
CID 140734839
CID 119080655
CID 119080655
CID 119080600
CID 119080600
1-N-[[2-[[[8-(dimethylamino)naphthalen-1-yl]-methylamino]methyl]phenyl]methyl]-1-N,8-N,8-N-trimethylnaphthalene-1,8-diamine
CID 155936920
bis[8-(dimethylamino)naphthalen-1-yl]-iodotellanium triiodide
CID 139159619
N,N,1-trimethylbenzo[g]indol-9-amine
CID 91691308
2-[[8-(dimethylamino)isoquinolin-1-yl]-methylamino]acetic acid
CID 82572831
bis[2,6-bis(dimethylamino)phenyl]tin
CID 11282229
1-N,1-N,9-N,9-N-tetramethyldibenzothiophene-1,9-diamine
CID 14024666

Frequently Asked Questions

What is the IUPAC name of 8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine?
The IUPAC name of 8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine (CID 101153069) is 8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine.
What is the SMILES notation for 8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine?
The canonical SMILES for 8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine is C#C[Si](C#C)(c1cccc2cccc(N(C)C)c12)c1cccc2cccc(N(C)C)c12.
What is the InChIKey of 8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine?
The InChIKey is WFBUEBGXROPSKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26N2Si/c1-7-31(8-2,25-19-11-15-21-13-9-17-23(27(21)25)29(3)4)26-20-12-16-22-14-10-18-24(28(22)26)30(5)6/h1-2,9-20H,3-6H3.
What are the key properties of 8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine?
8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine has a molecular weight of 418.62 g/mol, XLogP of 4.03, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[[8-(dimethylamino)naphthalen-1-yl]-diethynylsilyl]-N,N-dimethylnaphthalen-1-amine is sourced from PubChem (CID 101153069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).