1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine

C25H26N2 — CID 15514899

IUPAC1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine
SMILESCN(C)c1ccc2ccccc2c1Cc1c(N(C)C)ccc2ccccc12
InChIInChI=1S/C25H26N2/c1-26(2)24-15-13-18-9-5-7-11-20(18)22(24)17-23-21-12-8-6-10-19(21)14-16-25(23)27(3)4/h5-16H,17H2,1-4H3
InChIKeyLZKZFXFFDDFDNH-UHFFFAOYSA-N
MW354.50 g/mol
LogP5.72
Rot. Bonds4

About 1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine

1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine (PubChem CID 15514899) has the molecular formula C25H26N2 and a molecular weight of 354.50 g/mol. Its IUPAC name is 1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine.

Molecular Properties

Compound Name1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine
PubChem CID15514899
Molecular FormulaC25H26N2
Molecular Weight354.50 g/mol
Exact Mass354.21
IUPAC Name1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine
SMILESCN(C)c1ccc2ccccc2c1Cc1c(N(C)C)ccc2ccccc12
InChIInChI=1S/C25H26N2/c1-26(2)24-15-13-18-9-5-7-11-20(18)22(24)17-23-21-12-8-6-10-19(21)14-16-25(23)27(3)4/h5-16H,17H2,1-4H3
InChIKeyLZKZFXFFDDFDNH-UHFFFAOYSA-N
XLogP5.72
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.50
LogP ≤ 55.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N,1-trimethylnaphthalen-2-amine;hydrochloride
CID 174570104
1-ethenyl-N,N-dimethylnaphthalen-2-amine
CID 152636612
2-(dimethylamino)-N-methylnaphthalene-1-sulfonamide
CID 173250377
2-(dimethylamino)naphthalene-1-diazonium chloride
CID 88633498
9-(anthracen-9-ylmethyl)anthracene;ethane
CID 91026872
N,N-dimethyl-1-nitronaphthalen-2-amine
CID 154584370
[2-(dimethylamino)naphthalen-1-yl]oxyboronic acid
CID 175426704
N,N-dimethylnaphthalen-1-amine;hydroxylamine
CID 135773162
1-(2-dimethylphosphanylnaphthalen-1-yl)-N,N-dimethylnaphthalen-2-amine
CID 11078830
1-(dimethylamino)naphthalene-2-diazonium
CID 88633495
N,N-dimethylnaphthalen-1-amine;sulfuric acid
CID 159908177
1-[2-(dimethylamino)phenyl]naphthalen-2-ol
CID 56931923

Frequently Asked Questions

What is the IUPAC name of 1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine?
The IUPAC name of 1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine (CID 15514899) is 1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine.
What is the SMILES notation for 1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine?
The canonical SMILES for 1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine is CN(C)c1ccc2ccccc2c1Cc1c(N(C)C)ccc2ccccc12.
What is the InChIKey of 1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine?
The InChIKey is LZKZFXFFDDFDNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2/c1-26(2)24-15-13-18-9-5-7-11-20(18)22(24)17-23-21-12-8-6-10-19(21)14-16-25(23)27(3)4/h5-16H,17H2,1-4H3.
What are the key properties of 1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine?
1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine has a molecular weight of 354.50 g/mol, XLogP of 5.72, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(dimethylamino)naphthalen-1-yl]methyl]-N,N-dimethylnaphthalen-2-amine is sourced from PubChem (CID 15514899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).