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

C12H19N3O — CID 80873247

IUPAC6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(OC2CCC2)nc(C)n1
InChIInChI=1S/C12H19N3O/c1-3-7-13-11-8-12(15-9(2)14-11)16-10-5-4-6-10/h8,10H,3-7H2,1-2H3,(H,13,14,15)
InChIKeyMLMOSWAEGMAXFZ-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.54
Rot. Bonds5

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

6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine (PubChem CID 80873247) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine
PubChem CID80873247
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine
SMILESCCCNc1cc(OC2CCC2)nc(C)n1
InChIInChI=1S/C12H19N3O/c1-3-7-13-11-8-12(15-9(2)14-11)16-10-5-4-6-10/h8,10H,3-7H2,1-2H3,(H,13,14,15)
InChIKeyMLMOSWAEGMAXFZ-UHFFFAOYSA-N
XLogP2.54
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(2-cyclopentyloxyethyl)-2-methyl-6-N-propylpyrimidine-4,6-diamine
CID 80846025
N-ethyl-2-methyl-6-(1-methylpiperidin-4-yl)oxypyrimidin-4-amine
CID 80873426
N-ethyl-2-methyl-6-(oxan-4-yloxy)pyrimidin-4-amine
CID 80873271
6-(2-cyclopropylethoxy)-2-methyl-N-propylpyrimidin-4-amine
CID 114158202
6-cyclohexyloxy-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102719671
6-(3-methylcyclohexyl)oxy-N,2-dipropylpyrimidin-4-amine
CID 80943941
2-methyl-6-propoxy-N-propylpyrimidin-4-amine
CID 80866216
6-heptoxy-2-methyl-N-propylpyrimidin-4-amine
CID 80862052
N-cycloheptyl-N'-(6-ethoxy-2-methylpyrimidin-4-yl)ethane-1,2-diamine
CID 115306618
4-cyclobutyloxy-2,6-dimethylpyrimidine
CID 126953843
N-(cyclobutylmethyl)-6-ethoxy-2-methylpyrimidin-4-amine
CID 66326683
6-(3-methoxycyclohexyl)oxy-N,2-dimethylpyrimidin-4-amine
CID 80876574

Frequently Asked Questions

What is the IUPAC name of 6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine?
The IUPAC name of 6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine (CID 80873247) is 6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine?
The canonical SMILES for 6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine is CCCNc1cc(OC2CCC2)nc(C)n1.
What is the InChIKey of 6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine?
The InChIKey is MLMOSWAEGMAXFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-3-7-13-11-8-12(15-9(2)14-11)16-10-5-4-6-10/h8,10H,3-7H2,1-2H3,(H,13,14,15).
What are the key properties of 6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine?
6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine has a molecular weight of 221.30 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclobutyloxy-2-methyl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 80873247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).