2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine

C14H17N3O — CID 80941044

IUPAC2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine
SMILESCCc1nc(N)cc(OC(C)c2ccccc2)n1
InChIInChI=1S/C14H17N3O/c1-3-13-16-12(15)9-14(17-13)18-10(2)11-7-5-4-6-8-11/h4-10H,3H2,1-2H3,(H2,15,16,17)
InChIKeyJWZWLUWVQOACJM-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.76
Rot. Bonds4

About 2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine

2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine (PubChem CID 80941044) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine.

Molecular Properties

Compound Name2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine
PubChem CID80941044
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine
SMILESCCc1nc(N)cc(OC(C)c2ccccc2)n1
InChIInChI=1S/C14H17N3O/c1-3-13-16-12(15)9-14(17-13)18-10(2)11-7-5-4-6-8-11/h4-10H,3H2,1-2H3,(H2,15,16,17)
InChIKeyJWZWLUWVQOACJM-UHFFFAOYSA-N
XLogP2.76
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 ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(2-butan-2-ylphenoxy)-2-ethylpyrimidin-4-amine
CID 80941065
2-ethyl-6-(2-methoxyphenoxy)pyrimidin-4-amine
CID 80941255
4-chloro-2-methyl-6-(1-phenylethoxy)pyrimidine
CID 62483949
2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-1-phenylethanol
CID 80933367
6-butan-2-yloxy-2-phenylpyrimidin-4-amine
CID 112559900
2-ethyl-6-(5-methyl-2-propan-2-ylphenoxy)pyrimidin-4-amine
CID 80941059
2-methyl-6-(1-phenylethoxy)-N-propylpyrimidin-4-amine
CID 80859945
4-(1-phenylethoxy)-6-propoxy-1,3,5-triazin-2-amine
CID 80859517
2-ethyl-6-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyrimidin-4-amine
CID 112590912
2-methoxy-6-(1-phenylethoxy)pyridin-3-amine
CID 43262353
[2-(1-phenylethoxy)-4-pyridinyl]methanamine
CID 18071091
6-[3-(dimethylamino)phenoxy]-2-ethylpyrimidin-4-amine
CID 80941864

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine?
The IUPAC name of 2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine (CID 80941044) is 2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine.
What is the SMILES notation for 2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine?
The canonical SMILES for 2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine is CCc1nc(N)cc(OC(C)c2ccccc2)n1.
What is the InChIKey of 2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine?
The InChIKey is JWZWLUWVQOACJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-3-13-16-12(15)9-14(17-13)18-10(2)11-7-5-4-6-8-11/h4-10H,3H2,1-2H3,(H2,15,16,17).
What are the key properties of 2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine?
2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine has a molecular weight of 243.31 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-(1-phenylethoxy)pyrimidin-4-amine is sourced from PubChem (CID 80941044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).