(3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine

C19H24FN — CID 43109404

IUPAC(3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine
SMILESCc1ccc(C(N)c2c(C)c(C)c(C)c(C)c2C)cc1F
InChIInChI=1S/C19H24FN/c1-10-7-8-16(9-17(10)20)19(21)18-14(5)12(3)11(2)13(4)15(18)6/h7-9,19H,21H2,1-6H3
InChIKeySFDJJQHIWQCBRL-UHFFFAOYSA-N
MW285.41 g/mol
LogP4.72
Rot. Bonds2

About (3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine

(3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine (PubChem CID 43109404) has the molecular formula C19H24FN and a molecular weight of 285.41 g/mol. Its IUPAC name is (3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine.

Molecular Properties

Compound Name(3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine
PubChem CID43109404
Molecular FormulaC19H24FN
Molecular Weight285.41 g/mol
Exact Mass285.19
IUPAC Name(3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine
SMILESCc1ccc(C(N)c2c(C)c(C)c(C)c(C)c2C)cc1F
InChIInChI=1S/C19H24FN/c1-10-7-8-16(9-17(10)20)19(21)18-14(5)12(3)11(2)13(4)15(18)6/h7-9,19H,21H2,1-6H3
InChIKeySFDJJQHIWQCBRL-UHFFFAOYSA-N
XLogP4.72
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3-chloro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine
CID 63523104
(4-chloro-3-fluorophenyl)-(3-fluoro-4-methylphenyl)methanamine
CID 107996089
2,2-difluoro-1-(3-fluoro-4-methylphenyl)ethanamine
CID 80605936
(3-fluoro-4-methylphenyl)-(5-methylpyrimidin-2-yl)methanamine
CID 107129090
(3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine
CID 63156098
(2-chloro-4,5-dimethylphenyl)-(3-fluoro-4-methylphenyl)methanamine
CID 115483749
(2,3,5,6-tetramethylphenyl)-(3,4,5-trifluorophenyl)methanamine
CID 63184968
(2-chloro-5-fluorophenyl)-(3-fluoro-4-methylphenyl)methanamine
CID 105394677
(4-bromo-3-fluorophenyl)-(2,6-difluoro-3-methylphenyl)methanamine
CID 105027240
2-fluoro-4-[1-(3-fluoro-4-methylphenyl)ethyl]-1-methylbenzene
CID 145113474
5-[(3,5-difluoro-4-methylphenyl)-(3-fluoro-4-methylphenyl)methyl]-1,3-difluoro-2-methylbenzene
CID 153499802
(3-fluoro-4-methylphenyl)-(3-methoxyphenyl)methanamine
CID 60819510

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine?
The IUPAC name of (3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine (CID 43109404) is (3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine.
What is the SMILES notation for (3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine?
The canonical SMILES for (3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine is Cc1ccc(C(N)c2c(C)c(C)c(C)c(C)c2C)cc1F.
What is the InChIKey of (3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine?
The InChIKey is SFDJJQHIWQCBRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN/c1-10-7-8-16(9-17(10)20)19(21)18-14(5)12(3)11(2)13(4)15(18)6/h7-9,19H,21H2,1-6H3.
What are the key properties of (3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine?
(3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine has a molecular weight of 285.41 g/mol, XLogP of 4.72, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine is sourced from PubChem (CID 43109404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).