(4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine

C15H18N2O — CID 113297303

IUPAC(4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine
SMILESCOc1ccc(C(N)c2cncc(C)c2)cc1C
InChIInChI=1S/C15H18N2O/c1-10-6-13(9-17-8-10)15(16)12-4-5-14(18-3)11(2)7-12/h4-9,15H,16H2,1-3H3
InChIKeyXMPGBGOISPPKBU-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.76
Rot. Bonds3

About (4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine

(4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine (PubChem CID 113297303) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is (4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine.

Molecular Properties

Compound Name(4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine
PubChem CID113297303
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name(4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine
SMILESCOc1ccc(C(N)c2cncc(C)c2)cc1C
InChIInChI=1S/C15H18N2O/c1-10-6-13(9-17-8-10)15(16)12-4-5-14(18-3)11(2)7-12/h4-9,15H,16H2,1-3H3
InChIKeyXMPGBGOISPPKBU-UHFFFAOYSA-N
XLogP2.76
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methoxy-3-methylphenyl)-(4-methylphenyl)methanamine
CID 43379645
(3,4-dimethylphenyl)-(5-methoxy-3-pyridinyl)methanamine
CID 105025843
(4-fluoro-3-methoxyphenyl)-(4-methoxy-3-methylphenyl)methanamine
CID 81283664
(6-bromonaphthalen-2-yl)-(5-methyl-3-pyridinyl)methanamine
CID 105023264
(4-fluorophenyl)-(5-methyl-3-pyridinyl)methanamine
CID 115374243
(3-methoxy-4-methylphenyl)-pyrimidin-5-ylmethanamine
CID 115827248
(3-fluoro-4-methoxyphenyl)-(5-methoxy-3-pyridinyl)methanamine
CID 105026161
(4-methoxy-3-methylphenyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine
CID 114659334
(4-methoxy-1-methylpyrazol-5-yl)-(5-methyl-3-pyridinyl)methanamine
CID 105186353
(3-methoxy-4-methylphenyl)-(5-propan-2-yloxy-3-pyridinyl)methanamine
CID 105027423
(5-bromo-3-pyridinyl)-(3-fluoro-4-methoxyphenyl)methanamine
CID 43474213
1-(4-methoxy-3-methylphenyl)-2,2-dimethylpropan-1-amine
CID 43379636

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine?
The IUPAC name of (4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine (CID 113297303) is (4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine.
What is the SMILES notation for (4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine?
The canonical SMILES for (4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine is COc1ccc(C(N)c2cncc(C)c2)cc1C.
What is the InChIKey of (4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine?
The InChIKey is XMPGBGOISPPKBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-10-6-13(9-17-8-10)15(16)12-4-5-14(18-3)11(2)7-12/h4-9,15H,16H2,1-3H3.
What are the key properties of (4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine?
(4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine has a molecular weight of 242.32 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-3-methylphenyl)-(5-methyl-3-pyridinyl)methanamine is sourced from PubChem (CID 113297303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).