(5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine

C14H15FN2O — CID 79722314

IUPAC(5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine
SMILESCOc1ccc(C(N)c2ccc(F)cn2)c(C)c1
InChIInChI=1S/C14H15FN2O/c1-9-7-11(18-2)4-5-12(9)14(16)13-6-3-10(15)8-17-13/h3-8,14H,16H2,1-2H3
InChIKeyUIBUORJYJWBBPQ-UHFFFAOYSA-N
MW246.28 g/mol
LogP2.59
Rot. Bonds3

About (5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine

(5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine (PubChem CID 79722314) has the molecular formula C14H15FN2O and a molecular weight of 246.28 g/mol. Its IUPAC name is (5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine.

Molecular Properties

Compound Name(5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine
PubChem CID79722314
Molecular FormulaC14H15FN2O
Molecular Weight246.28 g/mol
Exact Mass246.12
IUPAC Name(5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine
SMILESCOc1ccc(C(N)c2ccc(F)cn2)c(C)c1
InChIInChI=1S/C14H15FN2O/c1-9-7-11(18-2)4-5-12(9)14(16)13-6-3-10(15)8-17-13/h3-8,14H,16H2,1-2H3
InChIKeyUIBUORJYJWBBPQ-UHFFFAOYSA-N
XLogP2.59
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.28
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-fluoro-2-methylphenyl)-(5-methylpyrazin-2-yl)methanamine
CID 105142831
(4-ethoxyphenyl)-(5-fluoro-2-pyridinyl)methanamine
CID 79722742
(2-fluoro-5-methylphenyl)-(4-methoxy-2-methylphenyl)methanamine
CID 62514630
(2,4-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanamine
CID 43198782
(3,5-dimethylphenyl)-(5-fluoro-2-pyridinyl)methanamine
CID 79722165
[(4-fluoro-2-methylphenyl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
CID 105256746
(2,4-dimethylphenyl)-(2-fluoro-4-methoxyphenyl)methanamine
CID 43561246
(4-methoxy-2-methylphenyl)-(5-methylfuran-2-yl)methanamine
CID 43464444
(2-fluoro-4-methoxyphenyl)-pyrimidin-4-ylmethanamine
CID 103395544
(S)-(4-methoxy-2-methylphenyl)-[4-(trifluoromethoxy)phenyl]methanamine
CID 171244237
(2-fluoro-4-methoxyphenyl)-(6-methoxypyridazin-3-yl)methanamine
CID 103395933
methyl 2-amino-2-(5-fluoro-2-pyridinyl)acetate
CID 131354217

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine?
The IUPAC name of (5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine (CID 79722314) is (5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine.
What is the SMILES notation for (5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine?
The canonical SMILES for (5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine is COc1ccc(C(N)c2ccc(F)cn2)c(C)c1.
What is the InChIKey of (5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine?
The InChIKey is UIBUORJYJWBBPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-9-7-11(18-2)4-5-12(9)14(16)13-6-3-10(15)8-17-13/h3-8,14H,16H2,1-2H3.
What are the key properties of (5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine?
(5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine has a molecular weight of 246.28 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-2-pyridinyl)-(4-methoxy-2-methylphenyl)methanamine is sourced from PubChem (CID 79722314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).