5-(1-fluoroethyl)-2-methoxy-N-methylaniline

C10H14FNO — CID 84659165

IUPAC5-(1-fluoroethyl)-2-methoxy-N-methylaniline
SMILESCNc1cc(C(C)F)ccc1OC
InChIInChI=1S/C10H14FNO/c1-7(11)8-4-5-10(13-3)9(6-8)12-2/h4-7,12H,1-3H3
InChIKeyHBLARJHZCYNVFY-UHFFFAOYSA-N
MW183.23 g/mol
LogP2.77
Rot. Bonds3

About 5-(1-fluoroethyl)-2-methoxy-N-methylaniline

5-(1-fluoroethyl)-2-methoxy-N-methylaniline (PubChem CID 84659165) has the molecular formula C10H14FNO and a molecular weight of 183.23 g/mol. Its IUPAC name is 5-(1-fluoroethyl)-2-methoxy-N-methylaniline.

Molecular Properties

Compound Name5-(1-fluoroethyl)-2-methoxy-N-methylaniline
PubChem CID84659165
Molecular FormulaC10H14FNO
Molecular Weight183.23 g/mol
Exact Mass183.11
IUPAC Name5-(1-fluoroethyl)-2-methoxy-N-methylaniline
SMILESCNc1cc(C(C)F)ccc1OC
InChIInChI=1S/C10H14FNO/c1-7(11)8-4-5-10(13-3)9(6-8)12-2/h4-7,12H,1-3H3
InChIKeyHBLARJHZCYNVFY-UHFFFAOYSA-N
XLogP2.77
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.23
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-iodo-2-methoxy-N-methylaniline
CID 82267247
2-methoxy-N-methyl-5-(2-methylpropyl)aniline
CID 138652047
2-methoxy-N-methyl-5-(trifluoromethyl)aniline
CID 21307264
1-[5-(1-fluoroethyl)-2-methoxyphenyl]ethanone
CID 84666890
1-(3-fluoro-4-methoxyphenyl)-N,N'-dimethylmethanediamine
CID 116954300
1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclobutan-1-amine
CID 117320262
1-[5-(1-fluoroethyl)-2-methoxyphenyl]cyclopentan-1-amine
CID 117347443
N-(2-methoxy-5-propan-2-ylphenyl)furan-2-carboxamide
CID 110776781
3-[5-(1-fluoroethyl)-2-methoxyphenyl]-1-methylpyrazol-5-amine
CID 117376001
2-[5-(1-fluoroethyl)-2-methoxyphenyl]pyrrolidine
CID 84688515
3-[5-(1-fluoroethyl)-2-methoxyphenyl]-3-methylbutanoic acid
CID 117389154
3-(3-fluoro-4-methoxyphenyl)-N-methylbutan-2-amine
CID 66436991

Frequently Asked Questions

What is the IUPAC name of 5-(1-fluoroethyl)-2-methoxy-N-methylaniline?
The IUPAC name of 5-(1-fluoroethyl)-2-methoxy-N-methylaniline (CID 84659165) is 5-(1-fluoroethyl)-2-methoxy-N-methylaniline.
What is the SMILES notation for 5-(1-fluoroethyl)-2-methoxy-N-methylaniline?
The canonical SMILES for 5-(1-fluoroethyl)-2-methoxy-N-methylaniline is CNc1cc(C(C)F)ccc1OC.
What is the InChIKey of 5-(1-fluoroethyl)-2-methoxy-N-methylaniline?
The InChIKey is HBLARJHZCYNVFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO/c1-7(11)8-4-5-10(13-3)9(6-8)12-2/h4-7,12H,1-3H3.
What are the key properties of 5-(1-fluoroethyl)-2-methoxy-N-methylaniline?
5-(1-fluoroethyl)-2-methoxy-N-methylaniline has a molecular weight of 183.23 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-fluoroethyl)-2-methoxy-N-methylaniline is sourced from PubChem (CID 84659165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).