N-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine

C12H21N3O — CID 62319502

IUPACN-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine
SMILESCCNc1cc(COC)nc(CC(C)C)n1
InChIInChI=1S/C12H21N3O/c1-5-13-11-7-10(8-16-4)14-12(15-11)6-9(2)3/h7,9H,5-6,8H2,1-4H3,(H,13,14,15)
InChIKeyQIGUCHORQYSGEX-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.25
Rot. Bonds6

About N-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine

N-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine (PubChem CID 62319502) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is N-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine
PubChem CID62319502
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC NameN-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine
SMILESCCNc1cc(COC)nc(CC(C)C)n1
InChIInChI=1S/C12H21N3O/c1-5-13-11-7-10(8-16-4)14-12(15-11)6-9(2)3/h7,9H,5-6,8H2,1-4H3,(H,13,14,15)
InChIKeyQIGUCHORQYSGEX-UHFFFAOYSA-N
XLogP2.25
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-butyl-N-ethyl-6-(methoxymethyl)pyrimidin-4-amine
CID 79412373
N-ethyl-6-methyl-2-(2-methylpropyl)pyrimidin-4-amine
CID 62191589
N-ethyl-6-(methoxymethyl)-2-[(2-methylphenyl)sulfanylmethyl]pyrimidin-4-amine
CID 66098661
2-cyclopropyl-N-ethyl-6-(methoxymethyl)pyrimidin-4-amine
CID 62320790
6-butoxy-N-ethyl-2-(2-methylpropyl)pyrimidin-4-amine
CID 82458095
2-(cyclohexylsulfanylmethyl)-N-ethyl-6-(methoxymethyl)pyrimidin-4-amine
CID 65144656
2-[(3-chlorophenyl)methyl]-N-ethyl-6-(methoxymethyl)pyrimidin-4-amine
CID 62320406
2-[(dimethylamino)methyl]-6-(methoxymethyl)-N-propylpyrimidin-4-amine
CID 79088984
2-(1-methoxyethyl)-6-(methoxymethyl)-N-propylpyrimidin-4-amine
CID 79617577
N-ethyl-6-(methoxymethyl)-2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pyrimidin-4-amine
CID 115998400
2-[2-(dimethylamino)ethyl]-6-(methoxymethyl)-N-propylpyrimidin-4-amine
CID 113291401
2-(azepan-1-yl)-N-ethyl-6-(methoxymethyl)pyrimidin-4-amine
CID 62318582

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine?
The IUPAC name of N-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine (CID 62319502) is N-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine?
The canonical SMILES for N-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine is CCNc1cc(COC)nc(CC(C)C)n1.
What is the InChIKey of N-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine?
The InChIKey is QIGUCHORQYSGEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-5-13-11-7-10(8-16-4)14-12(15-11)6-9(2)3/h7,9H,5-6,8H2,1-4H3,(H,13,14,15).
What are the key properties of N-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine?
N-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine has a molecular weight of 223.32 g/mol, XLogP of 2.25, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-(methoxymethyl)-2-(2-methylpropyl)pyrimidin-4-amine is sourced from PubChem (CID 62319502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).