N-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine

C14H21N5O — CID 62318594

IUPACN-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine
SMILESCCNc1cc(COC)nc(-c2c(C)nn(C)c2C)n1
InChIInChI=1S/C14H21N5O/c1-6-15-12-7-11(8-20-5)16-14(17-12)13-9(2)18-19(4)10(13)3/h7H,6,8H2,1-5H3,(H,15,16,17)
InChIKeyMFFAEAWUNBGBQC-UHFFFAOYSA-N
MW275.36 g/mol
LogP2.07
Rot. Bonds5

About N-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine

N-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine (PubChem CID 62318594) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is N-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine
PubChem CID62318594
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC NameN-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine
SMILESCCNc1cc(COC)nc(-c2c(C)nn(C)c2C)n1
InChIInChI=1S/C14H21N5O/c1-6-15-12-7-11(8-20-5)16-14(17-12)13-9(2)18-19(4)10(13)3/h7H,6,8H2,1-5H3,(H,15,16,17)
InChIKeyMFFAEAWUNBGBQC-UHFFFAOYSA-N
XLogP2.07
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine?
The IUPAC name of N-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine (CID 62318594) is N-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine?
The canonical SMILES for N-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine is CCNc1cc(COC)nc(-c2c(C)nn(C)c2C)n1.
What is the InChIKey of N-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine?
The InChIKey is MFFAEAWUNBGBQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-6-15-12-7-11(8-20-5)16-14(17-12)13-9(2)18-19(4)10(13)3/h7H,6,8H2,1-5H3,(H,15,16,17).
What are the key properties of N-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine?
N-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine has a molecular weight of 275.36 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-(methoxymethyl)-2-(1,3,5-trimethylpyrazol-4-yl)pyrimidin-4-amine is sourced from PubChem (CID 62318594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).