2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine

C14H17N3O — CID 62192979

IUPAC2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine
SMILESCCOc1cccc(-c2nc(N)cc(CC)n2)c1
InChIInChI=1S/C14H17N3O/c1-3-11-9-13(15)17-14(16-11)10-6-5-7-12(8-10)18-4-2/h5-9H,3-4H2,1-2H3,(H2,15,16,17)
InChIKeyANLVYIJBWKZPSO-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.69
Rot. Bonds4

About 2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine

2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine (PubChem CID 62192979) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine
PubChem CID62192979
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine
SMILESCCOc1cccc(-c2nc(N)cc(CC)n2)c1
InChIInChI=1S/C14H17N3O/c1-3-11-9-13(15)17-14(16-11)10-6-5-7-12(8-10)18-4-2/h5-9H,3-4H2,1-2H3,(H2,15,16,17)
InChIKeyANLVYIJBWKZPSO-UHFFFAOYSA-N
XLogP2.69
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-chlorophenyl)-6-ethylpyrimidin-4-amine
CID 62192624
[2-(3-ethoxyphenyl)-4,6-dimethylpyrimidin-5-yl]methanamine
CID 62746307
6-ethyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-amine
CID 62192267
6-(methoxymethyl)-2-(3-methoxyphenyl)pyrimidin-4-amine
CID 62319493
1-[2-(3-ethoxyphenyl)pyrimidin-4-yl]propan-2-amine
CID 62745398
3-(4,6-diethylpyrimidin-2-yl)aniline
CID 55205096
2-(3-ethoxyphenyl)-5-iodopyrimidin-4-amine
CID 66302482
6-ethyl-2-(4-ethylphenyl)pyrimidin-4-amine
CID 62190498
4-chloro-2-(3-ethoxyphenyl)-6-methylpyrimidine
CID 43557478
4-chloro-2-(3-ethoxyphenyl)-6-ethyl-5-methylpyrimidine
CID 55247750
5-chloro-3-(3-ethoxyphenyl)-1,2,4-oxadiazole
CID 60984808
2-(3-ethoxyphenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 61025887

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine?
The IUPAC name of 2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine (CID 62192979) is 2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine.
What is the SMILES notation for 2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine?
The canonical SMILES for 2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine is CCOc1cccc(-c2nc(N)cc(CC)n2)c1.
What is the InChIKey of 2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine?
The InChIKey is ANLVYIJBWKZPSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-3-11-9-13(15)17-14(16-11)10-6-5-7-12(8-10)18-4-2/h5-9H,3-4H2,1-2H3,(H2,15,16,17).
What are the key properties of 2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine?
2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine has a molecular weight of 243.31 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxyphenyl)-6-ethylpyrimidin-4-amine is sourced from PubChem (CID 62192979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).