2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine

C15H17BrN2 — CID 132933361

IUPAC2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine
SMILESCN(C)CC/N=C/c1cccc2cccc(Br)c12
InChIInChI=1S/C15H17BrN2/c1-18(2)10-9-17-11-13-7-3-5-12-6-4-8-14(16)15(12)13/h3-8,11H,9-10H2,1-2H3/b17-11+
InChIKeyUBDWBPGFBCNESN-GZTJUZNOSA-N
MW305.22 g/mol
LogP3.58
Rot. Bonds4

About 2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine

2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine (PubChem CID 132933361) has the molecular formula C15H17BrN2 and a molecular weight of 305.22 g/mol. Its IUPAC name is 2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine
PubChem CID132933361
Molecular FormulaC15H17BrN2
Molecular Weight305.22 g/mol
Exact Mass304.06
IUPAC Name2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine
SMILESCN(C)CC/N=C/c1cccc2cccc(Br)c12
InChIInChI=1S/C15H17BrN2/c1-18(2)10-9-17-11-13-7-3-5-12-6-4-8-14(16)15(12)13/h3-8,11H,9-10H2,1-2H3/b17-11+
InChIKeyUBDWBPGFBCNESN-GZTJUZNOSA-N
XLogP3.58
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.22
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-bromo-6-[2-(dimethylamino)ethyliminomethyl]phenol
CID 137090728
2,6-bis[3-(dimethylamino)propyliminomethyl]phenol
CID 136704302
8-bromonaphthalene-1-carbaldehyde
CID 13067255
N-[2-[2-(dimethylamino)ethyliminomethyl]phenyl]-2,6-di(propan-2-yl)aniline
CID 102262356
1-(2-bromophenyl)-N-butylmethanimine
CID 67388948
5-(diethylamino)-2-[2-(dimethylamino)ethyliminomethyl]phenol
CID 136879981
[(Z)-1-bromo-2-(8-bromonaphthalen-1-yl)ethenyl]-trimethylsilane
CID 15496786
N,N-dimethyl-2-[(2,3,4,5-tetrachlorophenyl)methylideneamino]ethanamine
CID 12048915
2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine
CID 102365312
(E)-3-(8-bromonaphthalen-1-yl)prop-2-enenitrile
CID 170362843
chloroplatinum(1+);N,N-dimethyl-2-[[2-(4-methylbenzene-6-id-1-yl)phenyl]methylideneamino]ethanamine
CID 66572690
1-bromo-8-methylnaphthalene
CID 4250949

Frequently Asked Questions

What is the IUPAC name of 2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine?
The IUPAC name of 2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine (CID 132933361) is 2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine.
What is the SMILES notation for 2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine?
The canonical SMILES for 2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine is CN(C)CC/N=C/c1cccc2cccc(Br)c12.
What is the InChIKey of 2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine?
The InChIKey is UBDWBPGFBCNESN-GZTJUZNOSA-N. The full InChI is InChI=1S/C15H17BrN2/c1-18(2)10-9-17-11-13-7-3-5-12-6-4-8-14(16)15(12)13/h3-8,11H,9-10H2,1-2H3/b17-11+.
What are the key properties of 2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine?
2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine has a molecular weight of 305.22 g/mol, XLogP of 3.58, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine is sourced from PubChem (CID 132933361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).