4-(2-aminoethyl)-2-fluoro-N-phenylaniline

C14H15FN2 — CID 82288843

IUPAC4-(2-aminoethyl)-2-fluoro-N-phenylaniline
SMILESNCCc1ccc(Nc2ccccc2)c(F)c1
InChIInChI=1S/C14H15FN2/c15-13-10-11(8-9-16)6-7-14(13)17-12-4-2-1-3-5-12/h1-7,10,17H,8-9,16H2
InChIKeyAZBIXEPWRNYTKA-UHFFFAOYSA-N
MW230.29 g/mol
LogP3.07
Rot. Bonds4

About 4-(2-aminoethyl)-2-fluoro-N-phenylaniline

4-(2-aminoethyl)-2-fluoro-N-phenylaniline (PubChem CID 82288843) has the molecular formula C14H15FN2 and a molecular weight of 230.29 g/mol. Its IUPAC name is 4-(2-aminoethyl)-2-fluoro-N-phenylaniline.

Molecular Properties

Compound Name4-(2-aminoethyl)-2-fluoro-N-phenylaniline
PubChem CID82288843
Molecular FormulaC14H15FN2
Molecular Weight230.29 g/mol
Exact Mass230.12
IUPAC Name4-(2-aminoethyl)-2-fluoro-N-phenylaniline
SMILESNCCc1ccc(Nc2ccccc2)c(F)c1
InChIInChI=1S/C14H15FN2/c15-13-10-11(8-9-16)6-7-14(13)17-12-4-2-1-3-5-12/h1-7,10,17H,8-9,16H2
InChIKeyAZBIXEPWRNYTKA-UHFFFAOYSA-N
XLogP3.07
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-aminoethyl)-N-(4-chlorophenyl)-2-fluoroaniline
CID 82303958
4-(aminomethyl)-N-(2-chlorophenyl)-2-fluoroaniline
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3-[4-(aminomethyl)-2-fluoroanilino]benzonitrile
CID 82292940
4-(aminomethyl)-2-fluoro-N-(4-methoxyphenyl)aniline
CID 82295213
2-[4-(3-chloroanilino)-3-fluorophenyl]acetic acid
CID 95483501
2-(3,4-difluorophenyl)ethanamine;hydrochloride
CID 66523804
2-(2-aminoethyl)-4-fluoro-N-(2-fluorophenyl)aniline
CID 82296258
2-(4-bromo-3-fluorophenyl)ethanamine
CID 66915310
2-[4-(2-phenylethyl)phenyl]ethanamine
CID 15036636
4-N-(2,4-difluorophenyl)benzene-1,4-diamine
CID 4764057
2-[3-fluoro-4-(2-methylanilino)phenyl]acetic acid
CID 82300980
12-N-(2-fluoro-4-phenylphenyl)-6-N-phenylchrysene-6,12-diamine
CID 90128123

Frequently Asked Questions

What is the IUPAC name of 4-(2-aminoethyl)-2-fluoro-N-phenylaniline?
The IUPAC name of 4-(2-aminoethyl)-2-fluoro-N-phenylaniline (CID 82288843) is 4-(2-aminoethyl)-2-fluoro-N-phenylaniline.
What is the SMILES notation for 4-(2-aminoethyl)-2-fluoro-N-phenylaniline?
The canonical SMILES for 4-(2-aminoethyl)-2-fluoro-N-phenylaniline is NCCc1ccc(Nc2ccccc2)c(F)c1.
What is the InChIKey of 4-(2-aminoethyl)-2-fluoro-N-phenylaniline?
The InChIKey is AZBIXEPWRNYTKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2/c15-13-10-11(8-9-16)6-7-14(13)17-12-4-2-1-3-5-12/h1-7,10,17H,8-9,16H2.
What are the key properties of 4-(2-aminoethyl)-2-fluoro-N-phenylaniline?
4-(2-aminoethyl)-2-fluoro-N-phenylaniline has a molecular weight of 230.29 g/mol, XLogP of 3.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminoethyl)-2-fluoro-N-phenylaniline is sourced from PubChem (CID 82288843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).