1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine

C10H16N4O — CID 103577439

IUPAC1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine
SMILESCOc1cnc(N2CC(C)C(N)C2)nc1
InChIInChI=1S/C10H16N4O/c1-7-5-14(6-9(7)11)10-12-3-8(15-2)4-13-10/h3-4,7,9H,5-6,11H2,1-2H3
InChIKeyVZQIAXAZYPZOGH-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.27
Rot. Bonds2

About 1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine

1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine (PubChem CID 103577439) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine
PubChem CID103577439
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine
SMILESCOc1cnc(N2CC(C)C(N)C2)nc1
InChIInChI=1S/C10H16N4O/c1-7-5-14(6-9(7)11)10-12-3-8(15-2)4-13-10/h3-4,7,9H,5-6,11H2,1-2H3
InChIKeyVZQIAXAZYPZOGH-UHFFFAOYSA-N
XLogP0.27
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine?
The IUPAC name of 1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine (CID 103577439) is 1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine.
What is the SMILES notation for 1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine?
The canonical SMILES for 1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine is COc1cnc(N2CC(C)C(N)C2)nc1.
What is the InChIKey of 1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine?
The InChIKey is VZQIAXAZYPZOGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-7-5-14(6-9(7)11)10-12-3-8(15-2)4-13-10/h3-4,7,9H,5-6,11H2,1-2H3.
What are the key properties of 1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine?
1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine has a molecular weight of 208.26 g/mol, XLogP of 0.27, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methoxypyrimidin-2-yl)-4-methylpyrrolidin-3-amine is sourced from PubChem (CID 103577439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).