[2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine

C10H15N3O — CID 121206851

IUPAC[2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine
SMILESCOCc1cc(CN)nc(C2CC2)n1
InChIInChI=1S/C10H15N3O/c1-14-6-9-4-8(5-11)12-10(13-9)7-2-3-7/h4,7H,2-3,5-6,11H2,1H3
InChIKeyNNXGEMVSBXTAGG-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.96
Rot. Bonds4

About [2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine

[2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine (PubChem CID 121206851) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is [2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine.

Molecular Properties

Compound Name[2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine
PubChem CID121206851
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name[2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine
SMILESCOCc1cc(CN)nc(C2CC2)n1
InChIInChI=1S/C10H15N3O/c1-14-6-9-4-8(5-11)12-10(13-9)7-2-3-7/h4,7H,2-3,5-6,11H2,1H3
InChIKeyNNXGEMVSBXTAGG-UHFFFAOYSA-N
XLogP0.96
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine?
The IUPAC name of [2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine (CID 121206851) is [2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine.
What is the SMILES notation for [2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine?
The canonical SMILES for [2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine is COCc1cc(CN)nc(C2CC2)n1.
What is the InChIKey of [2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine?
The InChIKey is NNXGEMVSBXTAGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-14-6-9-4-8(5-11)12-10(13-9)7-2-3-7/h4,7H,2-3,5-6,11H2,1H3.
What are the key properties of [2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine?
[2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine has a molecular weight of 193.25 g/mol, XLogP of 0.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-cyclopropyl-6-(methoxymethyl)pyrimidin-4-yl]methanamine is sourced from PubChem (CID 121206851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).