7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine

C14H20N4O — CID 62088791

IUPAC7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine
SMILESCOC1CCCC1n1c(C)c(C)c2c(N)ncnc21
InChIInChI=1S/C14H20N4O/c1-8-9(2)18(10-5-4-6-11(10)19-3)14-12(8)13(15)16-7-17-14/h7,10-11H,4-6H2,1-3H3,(H2,15,16,17)
InChIKeyZPRAJOZEOLNIMK-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.37
Rot. Bonds2

About 7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine

7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine (PubChem CID 62088791) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine
PubChem CID62088791
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine
SMILESCOC1CCCC1n1c(C)c(C)c2c(N)ncnc21
InChIInChI=1S/C14H20N4O/c1-8-9(2)18(10-5-4-6-11(10)19-3)14-12(8)13(15)16-7-17-14/h7,10-11H,4-6H2,1-3H3,(H2,15,16,17)
InChIKeyZPRAJOZEOLNIMK-UHFFFAOYSA-N
XLogP2.37
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine?
The IUPAC name of 7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine (CID 62088791) is 7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine is COC1CCCC1n1c(C)c(C)c2c(N)ncnc21.
What is the InChIKey of 7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine?
The InChIKey is ZPRAJOZEOLNIMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-8-9(2)18(10-5-4-6-11(10)19-3)14-12(8)13(15)16-7-17-14/h7,10-11H,4-6H2,1-3H3,(H2,15,16,17).
What are the key properties of 7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine?
7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine has a molecular weight of 260.34 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methoxycyclopentyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 62088791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).