2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine

C9H15N3O — CID 130483651

IUPAC2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine
SMILESCCOC(C)c1ncc(N)c(C)n1
InChIInChI=1S/C9H15N3O/c1-4-13-7(3)9-11-5-8(10)6(2)12-9/h5,7H,4,10H2,1-3H3
InChIKeyMTWNNULKZDJCHD-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.46
Rot. Bonds3

About 2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine

2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine (PubChem CID 130483651) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine.

Molecular Properties

Compound Name2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine
PubChem CID130483651
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine
SMILESCCOC(C)c1ncc(N)c(C)n1
InChIInChI=1S/C9H15N3O/c1-4-13-7(3)9-11-5-8(10)6(2)12-9/h5,7H,4,10H2,1-3H3
InChIKeyMTWNNULKZDJCHD-UHFFFAOYSA-N
XLogP1.46
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-ethoxyethyl)-5-iodo-6-methylpyrimidin-4-amine
CID 66306102
4-amino-2-(1-ethoxyethyl)pyrimidine-5-carboxylic acid
CID 116640823
methyl 4-amino-2-(1-ethoxyethyl)pyrimidine-5-carboxylate
CID 116646657
2-(1-ethoxyethyl)-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 114740686
1-[2-(1-ethoxyethyl)pyrimidin-5-yl]butan-2-amine
CID 64535247
5-bromo-2-(1-ethoxyethyl)pyrimidine-4-carboxylic acid
CID 106512081
2-(1-ethoxyethyl)-5,6,7,8-tetrahydroquinazolin-5-amine
CID 64533818
2-(1-ethoxyethyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
CID 114738462
ethane;2-ethyl-4-methylpyrimidin-5-amine
CID 142845626
2-(1-ethoxyethyl)-7,8-dihydro-6H-quinazolin-5-one
CID 64533619
N-[[2-(1-ethoxyethyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine
CID 64533832
1-[2-(1-ethoxybutyl)-4-methylpyrimidin-5-yl]-N-methylethanamine
CID 116731317

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine?
The IUPAC name of 2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine (CID 130483651) is 2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine.
What is the SMILES notation for 2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine?
The canonical SMILES for 2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine is CCOC(C)c1ncc(N)c(C)n1.
What is the InChIKey of 2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine?
The InChIKey is MTWNNULKZDJCHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-4-13-7(3)9-11-5-8(10)6(2)12-9/h5,7H,4,10H2,1-3H3.
What are the key properties of 2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine?
2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine has a molecular weight of 181.24 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethoxyethyl)-4-methylpyrimidin-5-amine is sourced from PubChem (CID 130483651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).