N-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine

C14H25N3O — CID 107816517

IUPACN-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine
SMILESCCCCC(CC)CNc1nc(C)cc(OC)n1
InChIInChI=1S/C14H25N3O/c1-5-7-8-12(6-2)10-15-14-16-11(3)9-13(17-14)18-4/h9,12H,5-8,10H2,1-4H3,(H,15,16,17)
InChIKeyGRSJYCHJLYQMTI-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.42
Rot. Bonds8

About N-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine

N-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine (PubChem CID 107816517) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is N-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine.

Molecular Properties

Compound NameN-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine
PubChem CID107816517
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC NameN-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine
SMILESCCCCC(CC)CNc1nc(C)cc(OC)n1
InChIInChI=1S/C14H25N3O/c1-5-7-8-12(6-2)10-15-14-16-11(3)9-13(17-14)18-4/h9,12H,5-8,10H2,1-4H3,(H,15,16,17)
InChIKeyGRSJYCHJLYQMTI-UHFFFAOYSA-N
XLogP3.42
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[(4,6-dimethoxypyrimidin-2-yl)amino]methyl]hexan-1-ol
CID 106115742
4-(2-ethylhexoxy)-N,6-dimethylpyrimidin-2-amine
CID 80861413
6-bromo-2-N-(2-ethylhexyl)pyrimidine-2,4-diamine
CID 114004473
3-[(4-methoxy-6-methylpyrimidin-2-yl)amino]-2-methylpropan-1-ol
CID 112691802
3-amino-4-[(4-methoxy-6-methylpyrimidin-2-yl)amino]butan-2-ol
CID 112634963
2-N-(2-ethylhexyl)-6-methoxypyridine-2,3-diamine
CID 114004558
N-(2-ethylhexyl)-5-methylpyrimidin-2-amine
CID 107816474
N-butyl-4,6-dimethoxypyrimidin-2-amine
CID 19737713
4-methoxy-6-methyl-N-(3-methylsulfanylbutyl)pyrimidin-2-amine
CID 115633959
N-(2-ethylhexyl)-4-methyl-1,3-thiazol-2-amine
CID 107816461
6-[(4-methoxy-6-methylpyrimidin-2-yl)amino]hexan-1-ol
CID 113351651
N-decyl-4,6-dimethoxypyrimidin-2-amine
CID 115355214

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine?
The IUPAC name of N-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine (CID 107816517) is N-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine.
What is the SMILES notation for N-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine?
The canonical SMILES for N-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine is CCCCC(CC)CNc1nc(C)cc(OC)n1.
What is the InChIKey of N-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine?
The InChIKey is GRSJYCHJLYQMTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-5-7-8-12(6-2)10-15-14-16-11(3)9-13(17-14)18-4/h9,12H,5-8,10H2,1-4H3,(H,15,16,17).
What are the key properties of N-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine?
N-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine has a molecular weight of 251.37 g/mol, XLogP of 3.42, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylhexyl)-4-methoxy-6-methylpyrimidin-2-amine is sourced from PubChem (CID 107816517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).