(3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine

C14H15FN2 — CID 63156098

IUPAC(3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine
SMILESCc1ccc(C(N)c2ccc(C)c(F)c2)cn1
InChIInChI=1S/C14H15FN2/c1-9-3-5-11(7-13(9)15)14(16)12-6-4-10(2)17-8-12/h3-8,14H,16H2,1-2H3
InChIKeyKTZKGQWVIIYDGU-UHFFFAOYSA-N
MW230.29 g/mol
LogP2.89
Rot. Bonds2

About (3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine

(3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine (PubChem CID 63156098) has the molecular formula C14H15FN2 and a molecular weight of 230.29 g/mol. Its IUPAC name is (3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine.

Molecular Properties

Compound Name(3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine
PubChem CID63156098
Molecular FormulaC14H15FN2
Molecular Weight230.29 g/mol
Exact Mass230.12
IUPAC Name(3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine
SMILESCc1ccc(C(N)c2ccc(C)c(F)c2)cn1
InChIInChI=1S/C14H15FN2/c1-9-3-5-11(7-13(9)15)14(16)12-6-4-10(2)17-8-12/h3-8,14H,16H2,1-2H3
InChIKeyKTZKGQWVIIYDGU-UHFFFAOYSA-N
XLogP2.89
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-fluoro-4-methylphenyl)-pyridin-3-ylmethanamine
CID 60923509
(3-fluoro-4-methylphenyl)-(5-methylpyrimidin-2-yl)methanamine
CID 107129090
(3-methylphenyl)-(6-methyl-3-pyridinyl)methanamine
CID 63156097
(3-fluoro-4-methylphenyl)-(1-methylpyrazol-4-yl)methanamine
CID 43124203
(4-chloro-3-fluorophenyl)-(3-fluoro-4-methylphenyl)methanamine
CID 107996089
(6-methyl-3-pyridinyl)-(4-propan-2-ylphenyl)methanamine
CID 55164666
(3,5-dichlorophenyl)-(6-methyl-3-pyridinyl)methanamine
CID 115854907
(3-fluoro-4-methylphenyl)-(2,3,4,5,6-pentamethylphenyl)methanamine
CID 43109404
(6-bromonaphthalen-2-yl)-(6-methyl-3-pyridinyl)methanamine
CID 115855045
(6-methyl-3-pyridinyl)-quinolin-6-ylmethanamine
CID 63155973
3-[amino-(6-methyl-3-pyridinyl)methyl]-N,N-dimethylaniline
CID 105146180
2,2-difluoro-1-(3-fluoro-4-methylphenyl)ethanamine
CID 80605936

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine?
The IUPAC name of (3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine (CID 63156098) is (3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine.
What is the SMILES notation for (3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine?
The canonical SMILES for (3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine is Cc1ccc(C(N)c2ccc(C)c(F)c2)cn1.
What is the InChIKey of (3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine?
The InChIKey is KTZKGQWVIIYDGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2/c1-9-3-5-11(7-13(9)15)14(16)12-6-4-10(2)17-8-12/h3-8,14H,16H2,1-2H3.
What are the key properties of (3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine?
(3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine has a molecular weight of 230.29 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine is sourced from PubChem (CID 63156098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).