2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine

C11H15FN2 — CID 102365312

IUPAC2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine
SMILESCN(C)CC/N=C/c1ccc(F)cc1
InChIInChI=1S/C11H15FN2/c1-14(2)8-7-13-9-10-3-5-11(12)6-4-10/h3-6,9H,7-8H2,1-2H3/b13-9+
InChIKeyXLNXJKLGHOWCLU-UKTHLTGXSA-N
MW194.25 g/mol
LogP1.81
Rot. Bonds4

About 2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine

2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine (PubChem CID 102365312) has the molecular formula C11H15FN2 and a molecular weight of 194.25 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine
PubChem CID102365312
Molecular FormulaC11H15FN2
Molecular Weight194.25 g/mol
Exact Mass194.12
IUPAC Name2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine
SMILESCN(C)CC/N=C/c1ccc(F)cc1
InChIInChI=1S/C11H15FN2/c1-14(2)8-7-13-9-10-3-5-11(12)6-4-10/h3-6,9H,7-8H2,1-2H3/b13-9+
InChIKeyXLNXJKLGHOWCLU-UKTHLTGXSA-N
XLogP1.81
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.25
LogP ≤ 51.81
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-[(4-tert-butylphenyl)methylideneamino]-N,N-dimethylethanamine;ethane
CID 143665839
N-ethyl-1-(4-fluorophenyl)methanimine
CID 59798639
2-(1H-imidazol-5-ylmethylideneamino)-N,N-dimethylethanamine
CID 136726194
1-(4-fluorophenyl)-N-trimethylsilylmethanimine
CID 86179040
2-bromo-6-[2-(dimethylamino)ethyliminomethyl]phenol
CID 137090728
N,N-dimethyl-3-[(2,3,4-trifluorophenyl)methylideneamino]propan-1-amine
CID 102365313
5-(diethylamino)-2-[2-(dimethylamino)ethyliminomethyl]phenol
CID 136879981
6-chloro-3-[2-(dimethylamino)ethyliminomethyl]-1H-indol-2-ol
CID 137006375
tert-butyl N-[3-[(4-fluorophenyl)methylideneamino]propyl]-N-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]carbamate
CID 11144852
2-[(8-bromonaphthalen-1-yl)methylideneamino]-N,N-dimethylethanamine
CID 132933361
2-[2-(dimethylamino)ethyliminomethyl]-5-(2-fluorophenyl)-3-hydroxycyclohex-2-en-1-one
CID 146459544
N-decyl-1-[4-(decyliminomethyl)phenyl]methanimine
CID 101093995

Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine?
The IUPAC name of 2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine (CID 102365312) is 2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine.
What is the SMILES notation for 2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine?
The canonical SMILES for 2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine is CN(C)CC/N=C/c1ccc(F)cc1.
What is the InChIKey of 2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine?
The InChIKey is XLNXJKLGHOWCLU-UKTHLTGXSA-N. The full InChI is InChI=1S/C11H15FN2/c1-14(2)8-7-13-9-10-3-5-11(12)6-4-10/h3-6,9H,7-8H2,1-2H3/b13-9+.
What are the key properties of 2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine?
2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine has a molecular weight of 194.25 g/mol, XLogP of 1.81, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)methylideneamino]-N,N-dimethylethanamine is sourced from PubChem (CID 102365312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).