N-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine

C16H21N3O2 — CID 80944699

IUPACN-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(NCC)cc(Oc2ccccc2OC)n1
InChIInChI=1S/C16H21N3O2/c1-4-8-14-18-15(17-5-2)11-16(19-14)21-13-10-7-6-9-12(13)20-3/h6-7,9-11H,4-5,8H2,1-3H3,(H,17,18,19)
InChIKeyAMSSYGSAYJGXMW-UHFFFAOYSA-N
MW287.36 g/mol
LogP3.66
Rot. Bonds7

About N-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine

N-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine (PubChem CID 80944699) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is N-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine
PubChem CID80944699
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC NameN-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(NCC)cc(Oc2ccccc2OC)n1
InChIInChI=1S/C16H21N3O2/c1-4-8-14-18-15(17-5-2)11-16(19-14)21-13-10-7-6-9-12(13)20-3/h6-7,9-11H,4-5,8H2,1-3H3,(H,17,18,19)
InChIKeyAMSSYGSAYJGXMW-UHFFFAOYSA-N
XLogP3.66
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-6-(2-methoxyphenoxy)-2-methylsulfanylpyrimidin-4-amine
CID 80869840
6-(2-chloro-5-methylphenoxy)-N-ethyl-2-propylpyrimidin-4-amine
CID 80942643
N-ethyl-6-hexoxy-2-propylpyrimidin-4-amine
CID 80950123
N-ethyl-6-heptoxy-2-propylpyrimidin-4-amine
CID 80950198
6-phenoxy-N,2-dipropylpyrimidin-4-amine
CID 80949625
6-(4-chlorophenoxy)-N-ethyl-2-propylpyrimidin-4-amine
CID 80949548
[3-[6-(ethylamino)-2-propylpyrimidin-4-yl]oxyphenyl]methanol
CID 80942920
N-ethyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine
CID 80949979
4-[6-(ethylamino)-2-propylpyrimidin-4-yl]oxybenzonitrile
CID 80944234
N,2-diethyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-amine
CID 80937644
6-(2-bromo-4-methoxyphenoxy)-N-methyl-2-propylpyrimidin-4-amine
CID 104708809
(6-phenoxy-2-propylpyrimidin-4-yl)hydrazine
CID 80946591

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine?
The IUPAC name of N-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine (CID 80944699) is N-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine.
What is the SMILES notation for N-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine?
The canonical SMILES for N-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine is CCCc1nc(NCC)cc(Oc2ccccc2OC)n1.
What is the InChIKey of N-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine?
The InChIKey is AMSSYGSAYJGXMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-4-8-14-18-15(17-5-2)11-16(19-14)21-13-10-7-6-9-12(13)20-3/h6-7,9-11H,4-5,8H2,1-3H3,(H,17,18,19).
What are the key properties of N-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine?
N-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine has a molecular weight of 287.36 g/mol, XLogP of 3.66, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-(2-methoxyphenoxy)-2-propylpyrimidin-4-amine is sourced from PubChem (CID 80944699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).