[3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol

C16H18FNO — CID 107130688

IUPAC[3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol
SMILESCc1ccc(C(O)c2cccc(N(C)C)c2)cc1F
InChIInChI=1S/C16H18FNO/c1-11-7-8-13(10-15(11)17)16(19)12-5-4-6-14(9-12)18(2)3/h4-10,16,19H,1-3H3
InChIKeyRMPUTNBKGJZZGF-UHFFFAOYSA-N
MW259.32 g/mol
LogP3.28
Rot. Bonds3

About [3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol

[3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol (PubChem CID 107130688) has the molecular formula C16H18FNO and a molecular weight of 259.32 g/mol. Its IUPAC name is [3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol.

Molecular Properties

Compound Name[3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol
PubChem CID107130688
Molecular FormulaC16H18FNO
Molecular Weight259.32 g/mol
Exact Mass259.14
IUPAC Name[3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol
SMILESCc1ccc(C(O)c2cccc(N(C)C)c2)cc1F
InChIInChI=1S/C16H18FNO/c1-11-7-8-13(10-15(11)17)16(19)12-5-4-6-14(9-12)18(2)3/h4-10,16,19H,1-3H3
InChIKeyRMPUTNBKGJZZGF-UHFFFAOYSA-N
XLogP3.28
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,3-difluoro-4-methylphenyl)-[3-(dimethylamino)phenyl]methanol
CID 107516253
[3-(dimethylamino)phenyl]-(2-fluoro-5-methylphenyl)methanol
CID 105094125
(3-fluoro-4-methylphenyl)-(3-iodophenyl)methanol
CID 107130674
(5-bromo-2-fluorophenyl)-[3-(dimethylamino)phenyl]methanol
CID 105113633
(3-cyclopropylphenyl)-(3-fluoro-4-methylphenyl)methanol
CID 107128110
3-[amino-(4-fluoro-3-methylphenyl)methyl]-N,N-dimethylaniline
CID 105142950
(4-chloro-3-methylphenyl)-(3-fluoro-4-methylphenyl)methanol
CID 107130625
(3,5-dimethoxyphenyl)-[3-(dimethylamino)phenyl]methanol
CID 105114451
(3-fluoro-4-methylphenyl)-pyrimidin-5-ylmethanol
CID 62490525
(3-fluoro-4-methylphenyl)-[3-fluoro-4-(trifluoromethyl)phenyl]methanol
CID 107287290
(3-fluoro-4-methylphenyl)-(4-methoxyphenyl)methanol
CID 60798694
(2-chloro-3-fluorophenyl)-(3-fluoro-4-methylphenyl)methanol
CID 107130732

Frequently Asked Questions

What is the IUPAC name of [3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol?
The IUPAC name of [3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol (CID 107130688) is [3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol.
What is the SMILES notation for [3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol?
The canonical SMILES for [3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol is Cc1ccc(C(O)c2cccc(N(C)C)c2)cc1F.
What is the InChIKey of [3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol?
The InChIKey is RMPUTNBKGJZZGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO/c1-11-7-8-13(10-15(11)17)16(19)12-5-4-6-14(9-12)18(2)3/h4-10,16,19H,1-3H3.
What are the key properties of [3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol?
[3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol has a molecular weight of 259.32 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(dimethylamino)phenyl]-(3-fluoro-4-methylphenyl)methanol is sourced from PubChem (CID 107130688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).