1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine

C13H22GaN — CID 88509359

IUPAC1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine
SMILESCC[Ga](CC)c1ccccc1CN(C)C
InChIInChI=1S/C9H12N.2C2H5.Ga/c1-10(2)8-9-6-4-3-5-7-9;2*1-2;/h3-6H,8H2,1-2H3;2*1H2,2H3;
InChIKeyKWAZZPIYCUKYGR-UHFFFAOYSA-N
MW262.05 g/mol
LogP2.49
Rot. Bonds5

About 1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine

1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine (PubChem CID 88509359) has the molecular formula C13H22GaN and a molecular weight of 262.05 g/mol. Its IUPAC name is 1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine
PubChem CID88509359
Molecular FormulaC13H22GaN
Molecular Weight262.05 g/mol
Exact Mass261.10
IUPAC Name1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine
SMILESCC[Ga](CC)c1ccccc1CN(C)C
InChIInChI=1S/C9H12N.2C2H5.Ga/c1-10(2)8-9-6-4-3-5-7-9;2*1-2;/h3-6H,8H2,1-2H3;2*1H2,2H3;
InChIKeyKWAZZPIYCUKYGR-UHFFFAOYSA-N
XLogP2.49
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.05
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[2-[(dimethylamino)methyl]phenyl]methanamine
CID 4962718
1-[2-[[2-[(dimethylamino)methyl]phenyl]methyl]phenyl]-N,N-dimethylmethanamine
CID 167700248
N,N-dimethyl-1-(2-propylphenyl)methanamine
CID 12709346
1-[2-(chloromethyl)phenyl]-N,N-dimethylmethanamine
CID 14459148
CID 138974220
CID 138974220
CID 12985165
CID 12985165
1-[2-(9H-fluoren-9-yl)phenyl]-N,N-dimethylmethanamine
CID 14710159
Tris(2-((dimethylamino)methyl)phenyl)germane
CID 15772942
hexamagnesium;hexakis([2-[(dimethylamino)methyl]phenyl]azanide)
CID 139241421
N,N-dimethyl-1-(2-octadecylphenyl)methanamine
CID 19374198
CID 138973114
CID 138973114
1-(2-dimethylstannylphenyl)-N,N-dimethylmethanamine
CID 14950094

Frequently Asked Questions

What is the IUPAC name of 1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine (CID 88509359) is 1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine is CC[Ga](CC)c1ccccc1CN(C)C.
What is the InChIKey of 1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine?
The InChIKey is KWAZZPIYCUKYGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N.2C2H5.Ga/c1-10(2)8-9-6-4-3-5-7-9;2*1-2;/h3-6H,8H2,1-2H3;2*1H2,2H3;.
What are the key properties of 1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine?
1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine has a molecular weight of 262.05 g/mol, XLogP of 2.49, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-diethylgallanylphenyl)-N,N-dimethylmethanamine is sourced from PubChem (CID 88509359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).