methoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde

C10H16N2O3 — CID 142960710

IUPACmethoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde
SMILESCC(C)Oc1ccnc(C=O)n1.COC
InChIInChI=1S/C8H10N2O2.C2H6O/c1-6(2)12-8-3-4-9-7(5-11)10-8;1-3-2/h3-6H,1-2H3;1-2H3
InChIKeyHZVMAGUEEZFCII-UHFFFAOYSA-N
MW212.25 g/mol
LogP1.34
Rot. Bonds3

About methoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde

methoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde (PubChem CID 142960710) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is methoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde.

Molecular Properties

Compound Namemethoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde
PubChem CID142960710
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC Namemethoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde
SMILESCC(C)Oc1ccnc(C=O)n1.COC
InChIInChI=1S/C8H10N2O2.C2H6O/c1-6(2)12-8-3-4-9-7(5-11)10-8;1-3-2/h3-6H,1-2H3;1-2H3
InChIKeyHZVMAGUEEZFCII-UHFFFAOYSA-N
XLogP1.34
TPSA61.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

4-methyl-6-propan-2-yloxypyrimidine-2-carbaldehyde
CID 83875379
4-(4-propan-2-ylphenyl)pyrimidine-2-carbaldehyde
CID 83918078
N-(2-methoxyethyl)-4-propan-2-yloxypyrimidin-2-amine
CID 112636373
4-propan-2-yloxy-N-prop-2-enylpyrimidin-2-amine
CID 112637442
2-(4-propan-2-yloxypyrimidin-2-yl)acetonitrile
CID 112639154
methyl 3-[methyl-(4-propan-2-yloxypyrimidin-2-yl)amino]propanoate
CID 112638970
4-ethylpyrimidine-2-carbaldehyde
CID 83872234
diethyl 2-(4-propan-2-yloxypyrimidin-2-yl)propanedioate
CID 104573477
4-propan-2-yloxy-N-propylpyrimidin-2-amine
CID 80860726
4-methyl-2-(4-propan-2-yloxypyrimidin-2-yl)pentanoic acid
CID 113428025
N-(1-cyclopropylpropan-2-yl)-4-propan-2-yloxypyrimidin-2-amine
CID 112637761
3-methoxy-2-[(4-propan-2-yloxypyrimidin-2-yl)amino]propanoic acid
CID 112636213

Frequently Asked Questions

What is the IUPAC name of methoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde?
The IUPAC name of methoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde (CID 142960710) is methoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde.
What is the SMILES notation for methoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde?
The canonical SMILES for methoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde is CC(C)Oc1ccnc(C=O)n1.COC.
What is the InChIKey of methoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde?
The InChIKey is HZVMAGUEEZFCII-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2.C2H6O/c1-6(2)12-8-3-4-9-7(5-11)10-8;1-3-2/h3-6H,1-2H3;1-2H3.
What are the key properties of methoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde?
methoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde has a molecular weight of 212.25 g/mol, XLogP of 1.34, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethane;4-propan-2-yloxypyrimidine-2-carbaldehyde is sourced from PubChem (CID 142960710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).