6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine

C13H21N3O2 — CID 114158214

IUPAC6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine
SMILESCCCNc1ncnc(OCCC2CC2)c1OC
InChIInChI=1S/C13H21N3O2/c1-3-7-14-12-11(17-2)13(16-9-15-12)18-8-6-10-4-5-10/h9-10H,3-8H2,1-2H3,(H,14,15,16)
InChIKeyKRRHVXCNBOBYDO-UHFFFAOYSA-N
MW251.33 g/mol
LogP2.49
Rot. Bonds8

About 6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine

6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine (PubChem CID 114158214) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine
PubChem CID114158214
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine
SMILESCCCNc1ncnc(OCCC2CC2)c1OC
InChIInChI=1S/C13H21N3O2/c1-3-7-14-12-11(17-2)13(16-9-15-12)18-8-6-10-4-5-10/h9-10H,3-8H2,1-2H3,(H,14,15,16)
InChIKeyKRRHVXCNBOBYDO-UHFFFAOYSA-N
XLogP2.49
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2-cyclobutylethoxy)-5-methoxy-N-propylpyrimidin-4-amine
CID 106207740
5-methoxy-6-[2-(2-methoxyethoxy)ethoxy]-N-propylpyrimidin-4-amine
CID 104568305
6-(2-cyclobutylethoxy)-N,5-dipropylpyrimidin-4-amine
CID 106207776
6-(2-cyclobutylethoxy)-5-methoxy-N-methylpyrimidin-4-amine
CID 106207741
6-(2-cyclopropylethoxy)-N,5-diethylpyrimidin-4-amine
CID 106207529
3,5-dichloro-6-(2-cyclopropylethoxy)-N-propylpyridin-2-amine
CID 106207557
5-bromo-6-(2-cyclopropylethoxy)-N-ethylpyrimidin-4-amine
CID 106207427
4-N-(2-cyclopropylethyl)-5-methyl-6-N-propylpyrimidine-4,6-diamine
CID 80847611
6-(2-cyclopropylethoxy)-3,5-difluoro-N-propylpyridin-2-amine
CID 106207560
6-[(4-bromophenyl)methoxy]-5-methoxy-N-propylpyrimidin-4-amine
CID 82807303
6-(2-cyclobutylethoxy)-5-methoxypyrimidin-4-amine
CID 106207794
5-ethyl-6-(2-methoxyethoxy)-N-propylpyrimidin-4-amine
CID 80859758

Frequently Asked Questions

What is the IUPAC name of 6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine?
The IUPAC name of 6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine (CID 114158214) is 6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine.
What is the SMILES notation for 6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine?
The canonical SMILES for 6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine is CCCNc1ncnc(OCCC2CC2)c1OC.
What is the InChIKey of 6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine?
The InChIKey is KRRHVXCNBOBYDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-3-7-14-12-11(17-2)13(16-9-15-12)18-8-6-10-4-5-10/h9-10H,3-8H2,1-2H3,(H,14,15,16).
What are the key properties of 6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine?
6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine has a molecular weight of 251.33 g/mol, XLogP of 2.49, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-cyclopropylethoxy)-5-methoxy-N-propylpyrimidin-4-amine is sourced from PubChem (CID 114158214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).