N-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine

C15H25N3O2 — CID 80990812

IUPACN-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(NCC)c(C)c(OC2CCOCC2)n1
InChIInChI=1S/C15H25N3O2/c1-4-6-13-17-14(16-5-2)11(3)15(18-13)20-12-7-9-19-10-8-12/h12H,4-10H2,1-3H3,(H,16,17,18)
InChIKeyQNHSVJFZFJJUQG-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.73
Rot. Bonds6

About N-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine

N-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine (PubChem CID 80990812) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine
PubChem CID80990812
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC NameN-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(NCC)c(C)c(OC2CCOCC2)n1
InChIInChI=1S/C15H25N3O2/c1-4-6-13-17-14(16-5-2)11(3)15(18-13)20-12-7-9-19-10-8-12/h12H,4-10H2,1-3H3,(H,16,17,18)
InChIKeyQNHSVJFZFJJUQG-UHFFFAOYSA-N
XLogP2.73
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(3,4-dimethylcyclohexyl)oxy-N,2-diethyl-5-methylpyrimidin-4-amine
CID 80991257
6-N,2-diethyl-5-methyl-4-N-(oxan-4-yl)pyrimidine-4,6-diamine
CID 80994246
[6-(3-ethylcyclohexyl)oxy-5-methyl-2-propylpyrimidin-4-yl]hydrazine
CID 81001432
4-chloro-6-cyclopentyloxy-5-methyl-2-propylpyrimidine
CID 80974080
N-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine
CID 80988348
N-ethyl-6-(3-methoxypropoxy)-5-methyl-2-propylpyrimidin-4-amine
CID 80988992
2-ethyl-5-methyl-6-(1-methylpiperidin-4-yl)oxy-N-propylpyrimidin-4-amine
CID 80991118
[2,5-dimethyl-6-(oxan-4-yloxy)pyrimidin-4-yl]hydrazine
CID 80919838
4-N-(2-cyclopropylethyl)-6-N-ethyl-5-methyl-2-propylpyrimidine-4,6-diamine
CID 80992927
3-[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]oxypropan-1-ol
CID 80988731
5-methyl-4-N-(oxolan-3-ylmethyl)-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80985429
6-N,5-dimethyl-4-N-(oxolan-3-ylmethyl)-2-propylpyrimidine-4,6-diamine
CID 80983011

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine?
The IUPAC name of N-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine (CID 80990812) is N-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine.
What is the SMILES notation for N-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine?
The canonical SMILES for N-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine is CCCc1nc(NCC)c(C)c(OC2CCOCC2)n1.
What is the InChIKey of N-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine?
The InChIKey is QNHSVJFZFJJUQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-4-6-13-17-14(16-5-2)11(3)15(18-13)20-12-7-9-19-10-8-12/h12H,4-10H2,1-3H3,(H,16,17,18).
What are the key properties of N-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine?
N-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine has a molecular weight of 279.38 g/mol, XLogP of 2.73, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methyl-6-(oxan-4-yloxy)-2-propylpyrimidin-4-amine is sourced from PubChem (CID 80990812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).