4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine

C12H21N3O2 — CID 113470425

IUPAC4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine
SMILESCCOc1cc(C)nc(NC(C)(C)COC)n1
InChIInChI=1S/C12H21N3O2/c1-6-17-10-7-9(2)13-11(14-10)15-12(3,4)8-16-5/h7H,6,8H2,1-5H3,(H,13,14,15)
InChIKeyPGOVBKAJGHRPTN-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.02
Rot. Bonds6

About 4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine

4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine (PubChem CID 113470425) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is 4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine.

Molecular Properties

Compound Name4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine
PubChem CID113470425
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine
SMILESCCOc1cc(C)nc(NC(C)(C)COC)n1
InChIInChI=1S/C12H21N3O2/c1-6-17-10-7-9(2)13-11(14-10)15-12(3,4)8-16-5/h7H,6,8H2,1-5H3,(H,13,14,15)
InChIKeyPGOVBKAJGHRPTN-UHFFFAOYSA-N
XLogP2.02
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1,3-dichloro-2-methylpropan-2-yl)-4-ethoxy-6-methylpyrimidin-2-amine
CID 112635793
4-[(4-ethoxy-6-methylpyrimidin-2-yl)amino]-4-methylpentanoic acid
CID 112634446
4-ethoxy-N-(5-methoxypentyl)-6-methylpyrimidin-2-amine
CID 114131177
4-ethoxy-6-methyl-N-prop-2-ynylpyrimidin-2-amine
CID 112637451
N-(2-chloropropyl)-4-ethoxy-6-methylpyrimidin-2-amine
CID 112635580
4-ethoxy-6-methyl-N-(2-methylsulfanylethyl)pyrimidin-2-amine
CID 112637746
N'-(4-ethoxy-6-methylpyrimidin-2-yl)-N-ethylethane-1,2-diamine
CID 112634830
4-ethoxy-6-methyl-N-(2-methyl-2-methylsulfonylpropyl)pyrimidin-2-amine
CID 112638194
N-cyclopropyl-4-ethoxy-6-methylpyrimidin-2-amine
CID 94830490
4-[(4-ethoxy-6-methylpyrimidin-2-yl)amino]butan-1-ol
CID 106842653
4-methyl-4-[(4-methyl-6-propoxypyrimidin-2-yl)amino]pentanoic acid
CID 115973000
4-ethoxy-N-[(3-methoxyphenyl)methyl]-6-methylpyrimidin-2-amine
CID 115974506

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine?
The IUPAC name of 4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine (CID 113470425) is 4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine.
What is the SMILES notation for 4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine?
The canonical SMILES for 4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine is CCOc1cc(C)nc(NC(C)(C)COC)n1.
What is the InChIKey of 4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine?
The InChIKey is PGOVBKAJGHRPTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-6-17-10-7-9(2)13-11(14-10)15-12(3,4)8-16-5/h7H,6,8H2,1-5H3,(H,13,14,15).
What are the key properties of 4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine?
4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine has a molecular weight of 239.32 g/mol, XLogP of 2.02, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-(1-methoxy-2-methylpropan-2-yl)-6-methylpyrimidin-2-amine is sourced from PubChem (CID 113470425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).