(6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine

C15H19N3O2 — CID 102950546

IUPAC(6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine
SMILESCCCOc1ccccc1C(N)c1cc(OC)ncn1
InChIInChI=1S/C15H19N3O2/c1-3-8-20-13-7-5-4-6-11(13)15(16)12-9-14(19-2)18-10-17-12/h4-7,9-10,15H,3,8,16H2,1-2H3
InChIKeyBJOFSFMFEVGBJX-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.32
Rot. Bonds6

About (6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine

(6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine (PubChem CID 102950546) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is (6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine.

Molecular Properties

Compound Name(6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine
PubChem CID102950546
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name(6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine
SMILESCCCOc1ccccc1C(N)c1cc(OC)ncn1
InChIInChI=1S/C15H19N3O2/c1-3-8-20-13-7-5-4-6-11(13)15(16)12-9-14(19-2)18-10-17-12/h4-7,9-10,15H,3,8,16H2,1-2H3
InChIKeyBJOFSFMFEVGBJX-UHFFFAOYSA-N
XLogP2.32
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-(2-methoxyethoxy)phenyl]-(6-methoxypyridazin-3-yl)methanamine
CID 103374065
(2-methoxyphenyl)-(6-methoxypyrimidin-4-yl)methanol
CID 102950226
(5-methyl-3-pyridinyl)-(2-propoxyphenyl)methanamine
CID 105180812
[2-(2-methoxyethoxy)phenyl]-(4-methyl-2-pyridinyl)methanamine
CID 104660123
(4-fluoro-3-methoxyphenyl)-(2-propoxyphenyl)methanamine
CID 105035771
(2-ethylphenyl)-(2-propoxyphenyl)methanamine
CID 105035937
(2-bromo-5-methylphenyl)-(2-propoxyphenyl)methanamine
CID 105036012
1-(6-methoxypyridazin-3-yl)-N-methyl-1-(2-propoxyphenyl)methanamine
CID 103374186
(5-fluoro-2-methylphenyl)-(2-propoxyphenyl)methanamine
CID 104660036
(5-bromo-2-methylphenyl)-(2-propoxyphenyl)methanamine
CID 105036006
(4,5-dimethylthiophen-2-yl)-(2-propoxyphenyl)methanamine
CID 105035938
(3-bromo-2,4-dimethoxyphenyl)-(6-methoxypyrimidin-4-yl)methanamine
CID 103523603

Frequently Asked Questions

What is the IUPAC name of (6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine?
The IUPAC name of (6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine (CID 102950546) is (6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine.
What is the SMILES notation for (6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine?
The canonical SMILES for (6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine is CCCOc1ccccc1C(N)c1cc(OC)ncn1.
What is the InChIKey of (6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine?
The InChIKey is BJOFSFMFEVGBJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-3-8-20-13-7-5-4-6-11(13)15(16)12-9-14(19-2)18-10-17-12/h4-7,9-10,15H,3,8,16H2,1-2H3.
What are the key properties of (6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine?
(6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine has a molecular weight of 273.34 g/mol, XLogP of 2.32, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxypyrimidin-4-yl)-(2-propoxyphenyl)methanamine is sourced from PubChem (CID 102950546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).