N-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine

C12H21N3O — CID 84591548

IUPACN-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine
SMILESCOCCN(CC(C)C)c1cc(C)ncn1
InChIInChI=1S/C12H21N3O/c1-10(2)8-15(5-6-16-4)12-7-11(3)13-9-14-12/h7,9-10H,5-6,8H2,1-4H3
InChIKeyCHHLKUWMFGZURY-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.89
Rot. Bonds6

About N-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine

N-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine (PubChem CID 84591548) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is N-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine
PubChem CID84591548
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC NameN-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine
SMILESCOCCN(CC(C)C)c1cc(C)ncn1
InChIInChI=1S/C12H21N3O/c1-10(2)8-15(5-6-16-4)12-7-11(3)13-9-14-12/h7,9-10H,5-6,8H2,1-4H3
InChIKeyCHHLKUWMFGZURY-UHFFFAOYSA-N
XLogP1.89
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine?
The IUPAC name of N-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine (CID 84591548) is N-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine.
What is the SMILES notation for N-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine?
The canonical SMILES for N-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine is COCCN(CC(C)C)c1cc(C)ncn1.
What is the InChIKey of N-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine?
The InChIKey is CHHLKUWMFGZURY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-10(2)8-15(5-6-16-4)12-7-11(3)13-9-14-12/h7,9-10H,5-6,8H2,1-4H3.
What are the key properties of N-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine?
N-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine has a molecular weight of 223.32 g/mol, XLogP of 1.89, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-6-methyl-N-(2-methylpropyl)pyrimidin-4-amine is sourced from PubChem (CID 84591548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).