4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine

C15H19N3O — CID 157488014

IUPAC4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine
SMILESCCc1cc(-c2ccc(OC(C)C)cc2)nc(N)n1
InChIInChI=1S/C15H19N3O/c1-4-12-9-14(18-15(16)17-12)11-5-7-13(8-6-11)19-10(2)3/h5-10H,4H2,1-3H3,(H2,16,17,18)
InChIKeyGHGRYGPHYPQVKQ-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.08
Rot. Bonds4

About 4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine

4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine (PubChem CID 157488014) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine
PubChem CID157488014
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine
SMILESCCc1cc(-c2ccc(OC(C)C)cc2)nc(N)n1
InChIInChI=1S/C15H19N3O/c1-4-12-9-14(18-15(16)17-12)11-5-7-13(8-6-11)19-10(2)3/h5-10H,4H2,1-3H3,(H2,16,17,18)
InChIKeyGHGRYGPHYPQVKQ-UHFFFAOYSA-N
XLogP3.08
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-tert-butylphenyl)-6-ethylpyrimidin-2-amine
CID 158829270
4-(2-amino-6-ethylpyrimidin-4-yl)benzaldehyde
CID 157220237
2-(4-propan-2-yloxyphenyl)-6-propylpyrimidin-4-amine
CID 62203678
4-(aminomethyl)-N,N-dimethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine;hydrochloride
CID 82022788
[6-(4-propan-2-yloxyphenyl)pyrimidin-4-yl]methanamine
CID 28908778
N,6-diethyl-2-(4-propan-2-yloxyphenyl)pyrimidin-4-amine
CID 63479154
4-(4-ethoxyphenyl)-6-propan-2-ylpyrimidin-2-amine
CID 82300036
1-[4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]-2,2,2-trifluoroethanone
CID 157463679
2-[2-methyl-4-(4-propan-2-yloxyphenyl)imidazol-1-yl]ethanamine
CID 95466244
4-ethoxy-6-(4-propan-2-yloxyphenyl)pteridin-2-amine
CID 68779202
3-(4-propan-2-yloxyphenyl)-1,2-oxazol-5-amine
CID 82472062
4-chloro-6-(4-propan-2-yloxyphenyl)-2-propylpyrimidine
CID 80946367

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine?
The IUPAC name of 4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine (CID 157488014) is 4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine.
What is the SMILES notation for 4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine?
The canonical SMILES for 4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine is CCc1cc(-c2ccc(OC(C)C)cc2)nc(N)n1.
What is the InChIKey of 4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine?
The InChIKey is GHGRYGPHYPQVKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-4-12-9-14(18-15(16)17-12)11-5-7-13(8-6-11)19-10(2)3/h5-10H,4H2,1-3H3,(H2,16,17,18).
What are the key properties of 4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine?
4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine has a molecular weight of 257.34 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-(4-propan-2-yloxyphenyl)pyrimidin-2-amine is sourced from PubChem (CID 157488014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).