[2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine

C15H25N3O2 — CID 115973751

IUPAC[2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine
SMILESCCOc1cc(C)nc(OCC2CCCCC2CN)n1
InChIInChI=1S/C15H25N3O2/c1-3-19-14-8-11(2)17-15(18-14)20-10-13-7-5-4-6-12(13)9-16/h8,12-13H,3-7,9-10,16H2,1-2H3
InChIKeyWOLVCGWMPRMSGD-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.33
Rot. Bonds6

About [2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine

[2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine (PubChem CID 115973751) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is [2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine.

Molecular Properties

Compound Name[2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine
PubChem CID115973751
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name[2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine
SMILESCCOc1cc(C)nc(OCC2CCCCC2CN)n1
InChIInChI=1S/C15H25N3O2/c1-3-19-14-8-11(2)17-15(18-14)20-10-13-7-5-4-6-12(13)9-16/h8,12-13H,3-7,9-10,16H2,1-2H3
InChIKeyWOLVCGWMPRMSGD-UHFFFAOYSA-N
XLogP2.33
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-[(6-ethoxy-2-methylpyrimidin-4-yl)oxymethyl]cyclopentyl]methanamine
CID 66331092
2-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclohexan-1-amine
CID 113395468
N-[2-(aminomethyl)cyclopentyl]-4-ethoxy-N,6-dimethylpyrimidin-2-amine
CID 112635004
4-[[2-(aminomethyl)cyclohexyl]methoxy]-2-methyl-1H-pyrimidin-6-one
CID 114586525
[2-[(6-methoxy-2-methylpyrimidin-4-yl)oxymethyl]cyclopentyl]methanamine
CID 66332275
3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine
CID 112635376
4-ethoxy-N-(2-ethylcyclohexyl)-6-methylpyrimidin-2-amine
CID 112637169
N-[2-(aminomethyl)cyclohexyl]-4-methyl-6-propoxypyrimidin-2-amine
CID 115973485
4-[[2-(aminomethyl)cyclohexyl]methoxy]-2-cyclopropyl-1H-pyrimidin-6-one
CID 114586522
[2-[(5-fluoropyrimidin-2-yl)oxymethyl]cyclopentyl]methanamine
CID 104606585
2-[2-(bromomethyl)piperidin-1-yl]-4-ethoxy-6-methylpyrimidine
CID 112635723
N-cyclopropyl-4-ethoxy-6-methylpyrimidin-2-amine
CID 94830490

Frequently Asked Questions

What is the IUPAC name of [2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine?
The IUPAC name of [2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine (CID 115973751) is [2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine.
What is the SMILES notation for [2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine?
The canonical SMILES for [2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine is CCOc1cc(C)nc(OCC2CCCCC2CN)n1.
What is the InChIKey of [2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine?
The InChIKey is WOLVCGWMPRMSGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-3-19-14-8-11(2)17-15(18-14)20-10-13-7-5-4-6-12(13)9-16/h8,12-13H,3-7,9-10,16H2,1-2H3.
What are the key properties of [2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine?
[2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine has a molecular weight of 279.38 g/mol, XLogP of 2.33, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine is sourced from PubChem (CID 115973751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).