1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine

C15H16FNO — CID 145011426

IUPAC1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine
SMILESCN(C)Cc1ccc(Oc2ccccc2F)cc1
InChIInChI=1S/C15H16FNO/c1-17(2)11-12-7-9-13(10-8-12)18-15-6-4-3-5-14(15)16/h3-10H,11H2,1-2H3
InChIKeyGMNQHUKLFBHYSI-UHFFFAOYSA-N
MW245.30 g/mol
LogP3.68
Rot. Bonds4

About 1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine

1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine (PubChem CID 145011426) has the molecular formula C15H16FNO and a molecular weight of 245.30 g/mol. Its IUPAC name is 1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine
PubChem CID145011426
Molecular FormulaC15H16FNO
Molecular Weight245.30 g/mol
Exact Mass245.12
IUPAC Name1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine
SMILESCN(C)Cc1ccc(Oc2ccccc2F)cc1
InChIInChI=1S/C15H16FNO/c1-17(2)11-12-7-9-13(10-8-12)18-15-6-4-3-5-14(15)16/h3-10H,11H2,1-2H3
InChIKeyGMNQHUKLFBHYSI-UHFFFAOYSA-N
XLogP3.68
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(chloromethyl)-4-(2-fluorophenoxy)benzene
CID 22293096
ethane;1-fluoro-2-phenoxybenzene
CID 170962676
ethane;1-(4-fluorophenyl)-N,N-dimethylmethanamine
CID 163403663
1-fluoro-2-[3-[4-[4-[3-(2-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene
CID 22338576
1-(2-chloro-2-nitrosoethyl)-4-(2-fluorophenoxy)benzene
CID 91152313
(1R)-1-[4-(2-fluorophenoxy)phenyl]propan-1-amine
CID 113247632
1,2-bis[2-[2-(2-fluorophenoxy)phenoxy]phenoxy]benzene
CID 22338502
N-methyl-N-[(4-phenoxyphenyl)methyl]-1-phenylmethanamine
CID 54074832
1-[4-[3,5-bis(trifluoromethyl)phenoxy]phenyl]-N,N-dimethylmethanamine
CID 145011453
1-(4-ethylphenoxy)-2,4-difluorobenzene
CID 70811757
N,N-dimethyl-1-phenylmethanamine;phosphane
CID 174524909
N,N-dimethyl-1-phenylmethanamine;hydrobromide
CID 71398520

Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine (CID 145011426) is 1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine is CN(C)Cc1ccc(Oc2ccccc2F)cc1.
What is the InChIKey of 1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine?
The InChIKey is GMNQHUKLFBHYSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO/c1-17(2)11-12-7-9-13(10-8-12)18-15-6-4-3-5-14(15)16/h3-10H,11H2,1-2H3.
What are the key properties of 1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine?
1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine has a molecular weight of 245.30 g/mol, XLogP of 3.68, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine is sourced from PubChem (CID 145011426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).