1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine

C13H21N3O — CID 83189189

IUPAC1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine
SMILESCNCc1cnc(OC2CCCCC2)nc1C
InChIInChI=1S/C13H21N3O/c1-10-11(8-14-2)9-15-13(16-10)17-12-6-4-3-5-7-12/h9,12,14H,3-8H2,1-2H3
InChIKeyUJIPCJUGOLGZNX-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.22
Rot. Bonds4

About 1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine

1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine (PubChem CID 83189189) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine
PubChem CID83189189
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine
SMILESCNCc1cnc(OC2CCCCC2)nc1C
InChIInChI=1S/C13H21N3O/c1-10-11(8-14-2)9-15-13(16-10)17-12-6-4-3-5-7-12/h9,12,14H,3-8H2,1-2H3
InChIKeyUJIPCJUGOLGZNX-UHFFFAOYSA-N
XLogP2.22
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-cyclopentyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine
CID 83189730
N-[(2-cyclohexyloxy-4-methylpyrimidin-5-yl)methyl]-2-methylpropan-1-amine
CID 83189345
(2-cyclohexyloxy-4-methylpyrimidin-5-yl)methanol
CID 83184474
N-methyl-1-[4-methyl-2-(2-methylcyclohexyl)oxypyrimidin-5-yl]methanamine
CID 83188969
N-methyl-1-[4-methyl-2-(oxolan-3-yloxy)pyrimidin-5-yl]methanamine
CID 83188779
1-[2-(2-cyclobutylethoxy)-4-methylpyrimidin-5-yl]-N-methylmethanamine
CID 106205527
N-[[2-(3-methoxycyclohexyl)oxy-4-methylpyrimidin-5-yl]methyl]cyclopropanamine
CID 83187646
1-[2-(2-cyclopropylethoxy)-4-methylpyrimidin-5-yl]-N-methylmethanamine
CID 106205327
N-methyl-1-[4-methyl-2-(oxolan-2-ylmethoxy)pyrimidin-5-yl]methanamine
CID 83189883
1-[2-(3,5-dimethoxyphenoxy)-4-methylpyrimidin-5-yl]-N-methylmethanamine
CID 83185420
[4-methyl-2-(4-methylcyclohexyl)oxypyrimidin-5-yl]methanol
CID 83184911
5-(chloromethyl)-2-(4,4-dimethylcyclohexyl)oxy-4-methylpyrimidine
CID 114341774

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine?
The IUPAC name of 1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine (CID 83189189) is 1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine?
The canonical SMILES for 1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine is CNCc1cnc(OC2CCCCC2)nc1C.
What is the InChIKey of 1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine?
The InChIKey is UJIPCJUGOLGZNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-10-11(8-14-2)9-15-13(16-10)17-12-6-4-3-5-7-12/h9,12,14H,3-8H2,1-2H3.
What are the key properties of 1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine?
1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine has a molecular weight of 235.33 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexyloxy-4-methylpyrimidin-5-yl)-N-methylmethanamine is sourced from PubChem (CID 83189189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).