5-ethyl-4-methoxy-6-methylpyrimidin-2-amine

C8H13N3O — CID 3281098

IUPAC5-ethyl-4-methoxy-6-methylpyrimidin-2-amine
SMILESCCc1c(C)nc(N)nc1OC
InChIInChI=1S/C8H13N3O/c1-4-6-5(2)10-8(9)11-7(6)12-3/h4H2,1-3H3,(H2,9,10,11)
InChIKeyBPMMMGDHKQIAKZ-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.94
Rot. Bonds2

About 5-ethyl-4-methoxy-6-methylpyrimidin-2-amine

5-ethyl-4-methoxy-6-methylpyrimidin-2-amine (PubChem CID 3281098) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 5-ethyl-4-methoxy-6-methylpyrimidin-2-amine.

Molecular Properties

Compound Name5-ethyl-4-methoxy-6-methylpyrimidin-2-amine
PubChem CID3281098
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name5-ethyl-4-methoxy-6-methylpyrimidin-2-amine
SMILESCCc1c(C)nc(N)nc1OC
InChIInChI=1S/C8H13N3O/c1-4-6-5(2)10-8(9)11-7(6)12-3/h4H2,1-3H3,(H2,9,10,11)
InChIKeyBPMMMGDHKQIAKZ-UHFFFAOYSA-N
XLogP0.94
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-Ethyl-4-methyl-6-(2,2,3,3-tetrafluoropropoxy)pyrimidin-2-amine
CID 755539
4-Butoxy-5-iodo-6-methylpyrimidin-2-amine
CID 135260417
2-(2,4-Dimethoxy-6-methylpyrimidin-5-yl)ethanol
CID 46885005
2-(2-Chloro-4-methoxy-6-methylpyrimidin-5-yl)ethanol
CID 46885006
2-Methoxy-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidine
CID 46885007
5-(2-Fluoroethyl)-2,4-dimethoxy-6-methylpyrimidine
CID 46885008
2-Chloro-5-(2-fluoroethyl)-4-methoxy-6-methylpyrimidine
CID 46885009
2-(2,4-Dimethoxy-6-methylpyrimidin-5-yl)ethyl acetate
CID 46885140
2-(2-Chloro-4-methoxy-6-methylpyrimidin-5-yl)ethyl acetate
CID 46885141
5-(2-Chloroethyl)-2,4-dimethoxy-6-methylpyrimidine
CID 46885143
4-Ethoxy-2,5,6-trimethylpyrimidine
CID 11062766
2,4-Dimethoxy-5,6-dimethylpyrimidine
CID 11378723

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-methoxy-6-methylpyrimidin-2-amine?
The IUPAC name of 5-ethyl-4-methoxy-6-methylpyrimidin-2-amine (CID 3281098) is 5-ethyl-4-methoxy-6-methylpyrimidin-2-amine.
What is the SMILES notation for 5-ethyl-4-methoxy-6-methylpyrimidin-2-amine?
The canonical SMILES for 5-ethyl-4-methoxy-6-methylpyrimidin-2-amine is CCc1c(C)nc(N)nc1OC.
What is the InChIKey of 5-ethyl-4-methoxy-6-methylpyrimidin-2-amine?
The InChIKey is BPMMMGDHKQIAKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-4-6-5(2)10-8(9)11-7(6)12-3/h4H2,1-3H3,(H2,9,10,11).
What are the key properties of 5-ethyl-4-methoxy-6-methylpyrimidin-2-amine?
5-ethyl-4-methoxy-6-methylpyrimidin-2-amine has a molecular weight of 167.21 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-methoxy-6-methylpyrimidin-2-amine is sourced from PubChem (CID 3281098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).