4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine

C10H16N4O — CID 107542184

IUPAC4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine
SMILESCN(c1nccc(CN)n1)C1CCOC1
InChIInChI=1S/C10H16N4O/c1-14(9-3-5-15-7-9)10-12-4-2-8(6-11)13-10/h2,4,9H,3,5-7,11H2,1H3
InChIKeyFUONKGBFAFAXBC-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.16
Rot. Bonds3

About 4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine

4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine (PubChem CID 107542184) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine
PubChem CID107542184
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine
SMILESCN(c1nccc(CN)n1)C1CCOC1
InChIInChI=1S/C10H16N4O/c1-14(9-3-5-15-7-9)10-12-4-2-8(6-11)13-10/h2,4,9H,3,5-7,11H2,1H3
InChIKeyFUONKGBFAFAXBC-UHFFFAOYSA-N
XLogP0.16
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine?
The IUPAC name of 4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine (CID 107542184) is 4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine?
The canonical SMILES for 4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine is CN(c1nccc(CN)n1)C1CCOC1.
What is the InChIKey of 4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine?
The InChIKey is FUONKGBFAFAXBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-14(9-3-5-15-7-9)10-12-4-2-8(6-11)13-10/h2,4,9H,3,5-7,11H2,1H3.
What are the key properties of 4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine?
4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine has a molecular weight of 208.26 g/mol, XLogP of 0.16, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-methyl-N-(oxolan-3-yl)pyrimidin-2-amine is sourced from PubChem (CID 107542184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).