N-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine

C15H19N3O — CID 116775791

IUPACN-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine
SMILESCCNc1cc(C)nc(C(OC)c2ccccc2)n1
InChIInChI=1S/C15H19N3O/c1-4-16-13-10-11(2)17-15(18-13)14(19-3)12-8-6-5-7-9-12/h5-10,14H,4H2,1-3H3,(H,16,17,18)
InChIKeyCZWDTDOQYLZWHL-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.95
Rot. Bonds5

About N-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine

N-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine (PubChem CID 116775791) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine
PubChem CID116775791
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine
SMILESCCNc1cc(C)nc(C(OC)c2ccccc2)n1
InChIInChI=1S/C15H19N3O/c1-4-16-13-10-11(2)17-15(18-13)14(19-3)12-8-6-5-7-9-12/h5-10,14H,4H2,1-3H3,(H,16,17,18)
InChIKeyCZWDTDOQYLZWHL-UHFFFAOYSA-N
XLogP2.95
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[ethoxy(phenyl)methyl]-N,6-dimethylpyrimidin-4-amine
CID 116775770
2-[ethoxy(phenyl)methyl]-4,6-dimethylpyrimidine
CID 10331991
N-[2-[[4-(ethylamino)-6-methylpyrimidin-2-yl]amino]ethyl]-2-phenylbutanamide
CID 122324495
2-benzyl-N-ethyl-6-methylpyrimidin-4-amine
CID 62191071
5-bromo-2-[methoxy(phenyl)methyl]-6-methyl-N-propylpyrimidin-4-amine
CID 116776521
N-ethyl-2-[3-[methoxy(phenyl)methyl]-1,2,4-oxadiazol-5-yl]propan-2-amine
CID 116743752
4-chloro-5-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidine
CID 116745810
4-[methoxy(phenyl)methyl]-6-methyl-1,3,5-triazin-2-amine
CID 116781866
2-[ethoxy(phenyl)methyl]-N-ethyl-5,6-dimethylpyrimidin-4-amine
CID 116776116
5-bromo-2-[methoxy(phenyl)methyl]-N-methyl-6-propylpyrimidin-4-amine
CID 116776623
N-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine
CID 63486103
4-tert-butyl-6-chloro-2-[methoxy(phenyl)methyl]pyrimidine
CID 116745724

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine?
The IUPAC name of N-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine (CID 116775791) is N-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine.
What is the SMILES notation for N-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine?
The canonical SMILES for N-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine is CCNc1cc(C)nc(C(OC)c2ccccc2)n1.
What is the InChIKey of N-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine?
The InChIKey is CZWDTDOQYLZWHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-4-16-13-10-11(2)17-15(18-13)14(19-3)12-8-6-5-7-9-12/h5-10,14H,4H2,1-3H3,(H,16,17,18).
What are the key properties of N-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine?
N-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine has a molecular weight of 257.34 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine is sourced from PubChem (CID 116775791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).