2-methyl-6-propoxy-N-propylpyrimidin-4-amine

C11H19N3O — CID 80866216

IUPAC2-methyl-6-propoxy-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(OCCC)nc(C)n1
InChIInChI=1S/C11H19N3O/c1-4-6-12-10-8-11(15-7-5-2)14-9(3)13-10/h8H,4-7H2,1-3H3,(H,12,13,14)
InChIKeyRQBCEODIOXMYLV-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.40
Rot. Bonds6

About 2-methyl-6-propoxy-N-propylpyrimidin-4-amine

2-methyl-6-propoxy-N-propylpyrimidin-4-amine (PubChem CID 80866216) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 2-methyl-6-propoxy-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-methyl-6-propoxy-N-propylpyrimidin-4-amine
PubChem CID80866216
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name2-methyl-6-propoxy-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(OCCC)nc(C)n1
InChIInChI=1S/C11H19N3O/c1-4-6-12-10-8-11(15-7-5-2)14-9(3)13-10/h8H,4-7H2,1-3H3,(H,12,13,14)
InChIKeyRQBCEODIOXMYLV-UHFFFAOYSA-N
XLogP2.40
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-heptoxy-2-methyl-N-propylpyrimidin-4-amine
CID 80862052
2-methyl-N-propyl-6-(3,3,3-trifluoropropoxy)pyrimidin-4-amine
CID 82959220
N',N'-dimethyl-N-(2-methyl-6-propoxypyrimidin-4-yl)propane-1,3-diamine
CID 82454010
6-(2-cyclopropylethoxy)-2-methyl-N-propylpyrimidin-4-amine
CID 114158202
N-butyl-6-ethoxy-2-methylpyrimidin-4-amine
CID 66327506
2-(methoxymethyl)-6-propoxy-N-propylpyrimidin-4-amine
CID 113401645
2-methyl-N-(3-morpholin-4-ylpropyl)-6-propoxypyrimidin-4-amine
CID 82453993
N-[(4-chlorophenyl)methyl]-2-methyl-6-propoxypyrimidin-4-amine
CID 82454030
6-(2-aminoethoxy)-N-ethyl-2-methylpyrimidin-4-amine
CID 121206106
6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine
CID 80873247
6-(furan-2-ylmethoxy)-2-methyl-N-propylpyrimidin-4-amine
CID 80858748
2-methyl-6-(4-methylpentan-2-yloxy)-N-propylpyrimidin-4-amine
CID 80860245

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-propoxy-N-propylpyrimidin-4-amine?
The IUPAC name of 2-methyl-6-propoxy-N-propylpyrimidin-4-amine (CID 80866216) is 2-methyl-6-propoxy-N-propylpyrimidin-4-amine.
What is the SMILES notation for 2-methyl-6-propoxy-N-propylpyrimidin-4-amine?
The canonical SMILES for 2-methyl-6-propoxy-N-propylpyrimidin-4-amine is CCCNc1cc(OCCC)nc(C)n1.
What is the InChIKey of 2-methyl-6-propoxy-N-propylpyrimidin-4-amine?
The InChIKey is RQBCEODIOXMYLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-4-6-12-10-8-11(15-7-5-2)14-9(3)13-10/h8H,4-7H2,1-3H3,(H,12,13,14).
What are the key properties of 2-methyl-6-propoxy-N-propylpyrimidin-4-amine?
2-methyl-6-propoxy-N-propylpyrimidin-4-amine has a molecular weight of 209.29 g/mol, XLogP of 2.40, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-propoxy-N-propylpyrimidin-4-amine is sourced from PubChem (CID 80866216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).