[4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol

C15H16FNO — CID 62120345

IUPAC[4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol
SMILESCc1cc(CO)ccc1N(C)c1ccc(F)cc1
InChIInChI=1S/C15H16FNO/c1-11-9-12(10-18)3-8-15(11)17(2)14-6-4-13(16)5-7-14/h3-9,18H,10H2,1-2H3
InChIKeyQMEFWPCLWAWKJI-UHFFFAOYSA-N
MW245.30 g/mol
LogP3.39
Rot. Bonds3

About [4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol

[4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol (PubChem CID 62120345) has the molecular formula C15H16FNO and a molecular weight of 245.30 g/mol. Its IUPAC name is [4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol.

Molecular Properties

Compound Name[4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol
PubChem CID62120345
Molecular FormulaC15H16FNO
Molecular Weight245.30 g/mol
Exact Mass245.12
IUPAC Name[4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol
SMILESCc1cc(CO)ccc1N(C)c1ccc(F)cc1
InChIInChI=1S/C15H16FNO/c1-11-9-12(10-18)3-8-15(11)17(2)14-6-4-13(16)5-7-14/h3-9,18H,10H2,1-2H3
InChIKeyQMEFWPCLWAWKJI-UHFFFAOYSA-N
XLogP3.39
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-methyl-4-[methyl(propan-2-yl)amino]phenyl]methanol
CID 62121374
4-(aminomethyl)-N-(4-ethylphenyl)-N,2-dimethylaniline
CID 55209345
[4-(N-ethyl-4-methylanilino)-3-methylphenyl]methanol
CID 62122401
[3-chloro-4-(4-ethyl-N-methylanilino)phenyl]methanol
CID 81151814
4-(aminomethyl)-N,2-dimethyl-N-phenylaniline
CID 60930151
4-(chloromethyl)-N,2-dimethyl-N-phenylaniline
CID 55221919
4-(aminomethyl)-2-chloro-N-(4-fluorophenyl)-N-methylaniline
CID 78924390
4-(chloromethyl)-N-(4-methoxyphenyl)-N,2-dimethylaniline
CID 55222249
[4-[2-ethoxyethyl(methyl)amino]-3-methylphenyl]methanol
CID 81058166
1-[4-(hydroxymethyl)-N,2-dimethylanilino]-2-methylpropan-2-ol
CID 79387346
[5-fluoro-2-(N-methylanilino)phenyl]methanol
CID 43313086
1-N-(4-ethylphenyl)-4-fluoro-1-N-methylbenzene-1,2-diamine
CID 62001859

Frequently Asked Questions

What is the IUPAC name of [4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol?
The IUPAC name of [4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol (CID 62120345) is [4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol.
What is the SMILES notation for [4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol?
The canonical SMILES for [4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol is Cc1cc(CO)ccc1N(C)c1ccc(F)cc1.
What is the InChIKey of [4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol?
The InChIKey is QMEFWPCLWAWKJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO/c1-11-9-12(10-18)3-8-15(11)17(2)14-6-4-13(16)5-7-14/h3-9,18H,10H2,1-2H3.
What are the key properties of [4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol?
[4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol has a molecular weight of 245.30 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-fluoro-N-methylanilino)-3-methylphenyl]methanol is sourced from PubChem (CID 62120345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).