N-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine

C11H19N3O2 — CID 114942889

IUPACN-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine
SMILESCCOC(C)(C)CNc1nccc(OC)n1
InChIInChI=1S/C11H19N3O2/c1-5-16-11(2,3)8-13-10-12-7-6-9(14-10)15-4/h6-7H,5,8H2,1-4H3,(H,12,13,14)
InChIKeyHQANJWQCKNCKME-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.71
Rot. Bonds6

About N-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine

N-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine (PubChem CID 114942889) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is N-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine.

Molecular Properties

Compound NameN-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine
PubChem CID114942889
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC NameN-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine
SMILESCCOC(C)(C)CNc1nccc(OC)n1
InChIInChI=1S/C11H19N3O2/c1-5-16-11(2,3)8-13-10-12-7-6-9(14-10)15-4/h6-7H,5,8H2,1-4H3,(H,12,13,14)
InChIKeyHQANJWQCKNCKME-UHFFFAOYSA-N
XLogP1.71
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-N-(2-methoxy-2-methylpropyl)pyrimidin-2-amine
CID 115658463
N-(2,2-difluoropropyl)-4-methoxypyrimidin-2-amine
CID 131107592
N-ethyl-4-methoxypyrimidin-2-amine
CID 20510275
ethyl 2-[(4-methoxypyrimidin-2-yl)amino]acetate
CID 55207180
4-ethoxy-N-(2,2,2-trifluoroethyl)pyrimidin-2-amine
CID 112636496
1-N-(4-methoxypyrimidin-2-yl)-2-N,2-N-dimethylpropane-1,2-diamine
CID 112684646
3-[[(4-ethoxypyrimidin-2-yl)amino]methyl]pentan-3-ol
CID 112637987
N-(4-methoxypyrimidin-2-yl)-N',N'-dimethylpropane-1,3-diamine
CID 112683349
1-[(4-ethoxypyrimidin-2-yl)amino]-2-methylbutan-2-ol
CID 112637981
N-(4-methoxypyrimidin-2-yl)-N'-propan-2-ylethane-1,2-diamine
CID 62664484
N-(2-methoxy-2-methylpropyl)-4-methylpyrimidin-2-amine
CID 115658471
N-(cyclopentylmethyl)-4-methoxypyrimidin-2-amine
CID 112684482

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine?
The IUPAC name of N-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine (CID 114942889) is N-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine.
What is the SMILES notation for N-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine?
The canonical SMILES for N-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine is CCOC(C)(C)CNc1nccc(OC)n1.
What is the InChIKey of N-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine?
The InChIKey is HQANJWQCKNCKME-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-5-16-11(2,3)8-13-10-12-7-6-9(14-10)15-4/h6-7H,5,8H2,1-4H3,(H,12,13,14).
What are the key properties of N-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine?
N-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine has a molecular weight of 225.29 g/mol, XLogP of 1.71, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-2-methylpropyl)-4-methoxypyrimidin-2-amine is sourced from PubChem (CID 114942889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).