2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine

C11H17N3O — CID 112710672

IUPAC2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine
SMILESCOc1ncnc(C2CCCC2N)c1C
InChIInChI=1S/C11H17N3O/c1-7-10(8-4-3-5-9(8)12)13-6-14-11(7)15-2/h6,8-9H,3-5,12H2,1-2H3
InChIKeyHLUNWISYZJRBHZ-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.39
Rot. Bonds2

About 2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine

2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine (PubChem CID 112710672) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine
PubChem CID112710672
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine
SMILESCOc1ncnc(C2CCCC2N)c1C
InChIInChI=1S/C11H17N3O/c1-7-10(8-4-3-5-9(8)12)13-6-14-11(7)15-2/h6,8-9H,3-5,12H2,1-2H3
InChIKeyHLUNWISYZJRBHZ-UHFFFAOYSA-N
XLogP1.39
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine?
The IUPAC name of 2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine (CID 112710672) is 2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine.
What is the SMILES notation for 2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine?
The canonical SMILES for 2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine is COc1ncnc(C2CCCC2N)c1C.
What is the InChIKey of 2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine?
The InChIKey is HLUNWISYZJRBHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-7-10(8-4-3-5-9(8)12)13-6-14-11(7)15-2/h6,8-9H,3-5,12H2,1-2H3.
What are the key properties of 2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine?
2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine has a molecular weight of 207.28 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-5-methylpyrimidin-4-yl)cyclopentan-1-amine is sourced from PubChem (CID 112710672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).