4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine

C11H19N3O — CID 112636364

IUPAC4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine
SMILESCCCOc1cc(C)nc(NC(C)C)n1
InChIInChI=1S/C11H19N3O/c1-5-6-15-10-7-9(4)13-11(14-10)12-8(2)3/h7-8H,5-6H2,1-4H3,(H,12,13,14)
InChIKeyIPOFCBMBUHIZFF-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.39
Rot. Bonds5

About 4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine

4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine (PubChem CID 112636364) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine
PubChem CID112636364
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine
SMILESCCCOc1cc(C)nc(NC(C)C)n1
InChIInChI=1S/C11H19N3O/c1-5-6-15-10-7-9(4)13-11(14-10)12-8(2)3/h7-8H,5-6H2,1-4H3,(H,12,13,14)
InChIKeyIPOFCBMBUHIZFF-UHFFFAOYSA-N
XLogP2.39
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-fluorophenyl)ethyl]-4-methyl-6-propoxypyrimidin-2-amine
CID 115974734
N-hexan-3-yl-4-methyl-6-propoxypyrimidin-2-amine
CID 112637434
1-N,1-N,3-trimethyl-2-N-(4-methyl-6-propoxypyrimidin-2-yl)butane-1,2-diamine
CID 115974718
4-methyl-N-(1-phenylpropyl)-6-propoxypyrimidin-2-amine
CID 115974921
3-methoxy-2-[(4-methyl-6-propoxypyrimidin-2-yl)amino]propan-1-ol
CID 114156370
4-methyl-6-propoxy-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyrimidin-2-amine
CID 106282926
4-methyl-6-propoxy-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-2-amine
CID 112637867
4-methyl-6-propoxy-N-(1-thiophen-2-ylethyl)pyrimidin-2-amine
CID 112636733
1-N,1-N,4-trimethyl-2-N-(4-methyl-6-propoxypyrimidin-2-yl)pentane-1,2-diamine
CID 115974797
1,1-dimethyl-2-(4-methyl-6-propoxypyrimidin-2-yl)hydrazine
CID 112638424
2-methyl-1-N-(4-methyl-6-propoxypyrimidin-2-yl)propane-1,2-diamine
CID 112635096
2-ethyl-2-[(4-methyl-6-propoxypyrimidin-2-yl)amino]propane-1,3-diol
CID 107866270

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine?
The IUPAC name of 4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine (CID 112636364) is 4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine.
What is the SMILES notation for 4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine?
The canonical SMILES for 4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine is CCCOc1cc(C)nc(NC(C)C)n1.
What is the InChIKey of 4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine?
The InChIKey is IPOFCBMBUHIZFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-5-6-15-10-7-9(4)13-11(14-10)12-8(2)3/h7-8H,5-6H2,1-4H3,(H,12,13,14).
What are the key properties of 4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine?
4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine has a molecular weight of 209.29 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-propan-2-yl-6-propoxypyrimidin-2-amine is sourced from PubChem (CID 112636364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).