5-methyl-6-propoxypyrimidin-4-amine

C8H13N3O — CID 80866562

IUPAC5-methyl-6-propoxypyrimidin-4-amine
SMILESCCCOc1ncnc(N)c1C
InChIInChI=1S/C8H13N3O/c1-3-4-12-8-6(2)7(9)10-5-11-8/h5H,3-4H2,1-2H3,(H2,9,10,11)
InChIKeyNFBZWPRXEKENNU-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.16
Rot. Bonds3

About 5-methyl-6-propoxypyrimidin-4-amine

5-methyl-6-propoxypyrimidin-4-amine (PubChem CID 80866562) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 5-methyl-6-propoxypyrimidin-4-amine.

Molecular Properties

Compound Name5-methyl-6-propoxypyrimidin-4-amine
PubChem CID80866562
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name5-methyl-6-propoxypyrimidin-4-amine
SMILESCCCOc1ncnc(N)c1C
InChIInChI=1S/C8H13N3O/c1-3-4-12-8-6(2)7(9)10-5-11-8/h5H,3-4H2,1-2H3,(H2,9,10,11)
InChIKeyNFBZWPRXEKENNU-UHFFFAOYSA-N
XLogP1.16
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(2-ethoxyethoxy)-5-methylpyrimidin-4-amine
CID 80858667
6-[2-(dimethylamino)ethoxy]-5-methylpyrimidin-4-amine
CID 80871385
5-methyl-6-(4,4,4-trifluorobutoxy)pyrimidin-4-amine
CID 82794815
6-[(E)-but-2-enoxy]-5-methylpyrimidin-4-amine
CID 80872151
3-propoxypyrazin-2-amine
CID 102987993
6-(furan-2-ylmethoxy)-5-methylpyrimidin-4-amine
CID 80858744
4-propoxyquinazolin-6-amine
CID 64587338
6-heptoxy-5-propan-2-ylpyrimidin-4-amine
CID 80861295
4-(3-methoxy-3-methylbutoxy)-6-propoxypyrimidin-5-amine
CID 106664845
6-(4-methoxyphenoxy)-5-methylpyrimidin-4-amine
CID 80870116
4-(4-bromo-3,5-dimethylphenoxy)-6-propoxypyrimidin-5-amine
CID 107722498
5-propan-2-yl-6-(4-propoxyphenoxy)pyrimidin-4-amine
CID 80874994

Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-propoxypyrimidin-4-amine?
The IUPAC name of 5-methyl-6-propoxypyrimidin-4-amine (CID 80866562) is 5-methyl-6-propoxypyrimidin-4-amine.
What is the SMILES notation for 5-methyl-6-propoxypyrimidin-4-amine?
The canonical SMILES for 5-methyl-6-propoxypyrimidin-4-amine is CCCOc1ncnc(N)c1C.
What is the InChIKey of 5-methyl-6-propoxypyrimidin-4-amine?
The InChIKey is NFBZWPRXEKENNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-3-4-12-8-6(2)7(9)10-5-11-8/h5H,3-4H2,1-2H3,(H2,9,10,11).
What are the key properties of 5-methyl-6-propoxypyrimidin-4-amine?
5-methyl-6-propoxypyrimidin-4-amine has a molecular weight of 167.21 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-propoxypyrimidin-4-amine is sourced from PubChem (CID 80866562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).