2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine

C10H17N3O — CID 64571505

IUPAC2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine
SMILESCCC(C)(N)COc1cc(C)ncn1
InChIInChI=1S/C10H17N3O/c1-4-10(3,11)6-14-9-5-8(2)12-7-13-9/h5,7H,4,6,11H2,1-3H3
InChIKeyPLMFLMWNYOIHFC-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.29
Rot. Bonds4

About 2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine

2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine (PubChem CID 64571505) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine.

Molecular Properties

Compound Name2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine
PubChem CID64571505
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine
SMILESCCC(C)(N)COc1cc(C)ncn1
InChIInChI=1S/C10H17N3O/c1-4-10(3,11)6-14-9-5-8(2)12-7-13-9/h5,7H,4,6,11H2,1-3H3
InChIKeyPLMFLMWNYOIHFC-UHFFFAOYSA-N
XLogP1.29
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine?
The IUPAC name of 2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine (CID 64571505) is 2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine.
What is the SMILES notation for 2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine?
The canonical SMILES for 2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine is CCC(C)(N)COc1cc(C)ncn1.
What is the InChIKey of 2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine?
The InChIKey is PLMFLMWNYOIHFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-4-10(3,11)6-14-9-5-8(2)12-7-13-9/h5,7H,4,6,11H2,1-3H3.
What are the key properties of 2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine?
2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine has a molecular weight of 195.27 g/mol, XLogP of 1.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(6-methylpyrimidin-4-yl)oxybutan-2-amine is sourced from PubChem (CID 64571505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).