N,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine

C15H19N3O — CID 80864328

IUPACN,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine
SMILESCNc1ncc(C)c(Oc2cccc(C(C)C)c2)n1
InChIInChI=1S/C15H19N3O/c1-10(2)12-6-5-7-13(8-12)19-14-11(3)9-17-15(16-4)18-14/h5-10H,1-4H3,(H,16,17,18)
InChIKeyWYAICZNCTFYSIW-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.74
Rot. Bonds4

About N,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine

N,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine (PubChem CID 80864328) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine.

Molecular Properties

Compound NameN,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine
PubChem CID80864328
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine
SMILESCNc1ncc(C)c(Oc2cccc(C(C)C)c2)n1
InChIInChI=1S/C15H19N3O/c1-10(2)12-6-5-7-13(8-12)19-14-11(3)9-17-15(16-4)18-14/h5-10H,1-4H3,(H,16,17,18)
InChIKeyWYAICZNCTFYSIW-UHFFFAOYSA-N
XLogP3.74
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-methyl-4-(3-propan-2-ylphenoxy)-N-propylpyrimidin-2-amine
CID 80865695
4-(3-ethylphenoxy)-N,5-dimethylpyrimidin-2-amine
CID 80860603
N,5-dimethyl-4-quinolin-3-yloxypyrimidin-2-amine
CID 107388464
5-chloro-N-methyl-4-(2-methyl-5-propan-2-ylphenoxy)pyrimidin-2-amine
CID 80874319
[5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol
CID 80628637
N,5-dimethyl-4-propan-2-yloxypyrimidin-2-amine
CID 80859947
3-(2-hydrazinyl-5-methylpyrimidin-4-yl)oxy-N,N-dimethylaniline
CID 80920463
4-(4-chloro-2-methyl-5-propan-2-ylphenoxy)-N,5-dimethylpyrimidin-2-amine
CID 80875963
N-methyl-6-(3-propan-2-ylphenoxy)pyrazin-2-amine
CID 80863588
2-N,2-N,4-N-trimethyl-6-(3-propan-2-ylphenoxy)-1,3,5-triazine-2,4-diamine
CID 80865696
4-(3-tert-butylphenoxy)-N-ethyl-5-methylpyrimidin-2-amine
CID 80874250
1,3-bis(3-propan-2-ylphenoxy)benzene
CID 90260311

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine?
The IUPAC name of N,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine (CID 80864328) is N,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine.
What is the SMILES notation for N,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine?
The canonical SMILES for N,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine is CNc1ncc(C)c(Oc2cccc(C(C)C)c2)n1.
What is the InChIKey of N,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine?
The InChIKey is WYAICZNCTFYSIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-10(2)12-6-5-7-13(8-12)19-14-11(3)9-17-15(16-4)18-14/h5-10H,1-4H3,(H,16,17,18).
What are the key properties of N,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine?
N,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine has a molecular weight of 257.34 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine is sourced from PubChem (CID 80864328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).