5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine

C15H20N4O — CID 51040496

IUPAC5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine
SMILESCOc1cnc(-c2ccccn2)nc1N(C)CC(C)C
InChIInChI=1S/C15H20N4O/c1-11(2)10-19(3)15-13(20-4)9-17-14(18-15)12-7-5-6-8-16-12/h5-9,11H,10H2,1-4H3
InChIKeyDFGRFFJYADIACU-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.64
Rot. Bonds5

About 5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine

5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine (PubChem CID 51040496) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine
PubChem CID51040496
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine
SMILESCOc1cnc(-c2ccccn2)nc1N(C)CC(C)C
InChIInChI=1S/C15H20N4O/c1-11(2)10-19(3)15-13(20-4)9-17-14(18-15)12-7-5-6-8-16-12/h5-9,11H,10H2,1-4H3
InChIKeyDFGRFFJYADIACU-UHFFFAOYSA-N
XLogP2.64
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine?
The IUPAC name of 5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine (CID 51040496) is 5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine.
What is the SMILES notation for 5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine?
The canonical SMILES for 5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine is COc1cnc(-c2ccccn2)nc1N(C)CC(C)C.
What is the InChIKey of 5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine?
The InChIKey is DFGRFFJYADIACU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-11(2)10-19(3)15-13(20-4)9-17-14(18-15)12-7-5-6-8-16-12/h5-9,11H,10H2,1-4H3.
What are the key properties of 5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine?
5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine has a molecular weight of 272.35 g/mol, XLogP of 2.64, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-methyl-N-(2-methylpropyl)-2-pyridin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 51040496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).