3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine

C12H19N3O2 — CID 112635376

IUPAC3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine
SMILESCCOc1cc(C)nc(OC2CCC(N)C2)n1
InChIInChI=1S/C12H19N3O2/c1-3-16-11-6-8(2)14-12(15-11)17-10-5-4-9(13)7-10/h6,9-10H,3-5,7,13H2,1-2H3
InChIKeyMLNKCXRHOFLGFQ-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.44
Rot. Bonds4

About 3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine

3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine (PubChem CID 112635376) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine.

Molecular Properties

Compound Name3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine
PubChem CID112635376
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine
SMILESCCOc1cc(C)nc(OC2CCC(N)C2)n1
InChIInChI=1S/C12H19N3O2/c1-3-16-11-6-8(2)14-12(15-11)17-10-5-4-9(13)7-10/h6,9-10H,3-5,7,13H2,1-2H3
InChIKeyMLNKCXRHOFLGFQ-UHFFFAOYSA-N
XLogP1.44
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4,6-dimethylpyrimidin-2-yl)oxycyclopentan-1-amine
CID 79466039
2-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclohexan-1-amine
CID 113395468
4-(4-methoxy-6-methylpyrimidin-2-yl)oxycyclohexan-1-amine
CID 112635329
3-(6-methylpyrimidin-4-yl)oxycyclopentan-1-amine
CID 79466130
3-(6-ethoxy-2-methylpyrimidin-4-yl)oxycyclobutan-1-amine
CID 66331296
[2-[(4-ethoxy-6-methylpyrimidin-2-yl)oxymethyl]cyclohexyl]methanamine
CID 115973751
3-(2,6-dimethylpyrimidin-4-yl)oxycyclohexan-1-amine
CID 79465433
N-cyclopropyl-4-ethoxy-6-methylpyrimidin-2-amine
CID 94830490
3-(6-propoxypyrimidin-4-yl)oxycyclopentan-1-amine
CID 79465205
1-N-(4-ethoxy-6-methylpyrimidin-2-yl)cyclopropane-1,2-diamine
CID 112634745
1-(4-ethoxy-6-methylpyrimidin-2-yl)-5-methylpiperidin-3-amine
CID 112635064
1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidin-3-amine
CID 112634785

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine?
The IUPAC name of 3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine (CID 112635376) is 3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine.
What is the SMILES notation for 3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine?
The canonical SMILES for 3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine is CCOc1cc(C)nc(OC2CCC(N)C2)n1.
What is the InChIKey of 3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine?
The InChIKey is MLNKCXRHOFLGFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-3-16-11-6-8(2)14-12(15-11)17-10-5-4-9(13)7-10/h6,9-10H,3-5,7,13H2,1-2H3.
What are the key properties of 3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine?
3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine has a molecular weight of 237.30 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxy-6-methylpyrimidin-2-yl)oxycyclopentan-1-amine is sourced from PubChem (CID 112635376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).