5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine

C15H19N3O — CID 116976965

IUPAC5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine
SMILESCNc1ncc(-c2ccc(OC)c(C(C)C)c2)cn1
InChIInChI=1S/C15H19N3O/c1-10(2)13-7-11(5-6-14(13)19-4)12-8-17-15(16-3)18-9-12/h5-10H,1-4H3,(H,16,17,18)
InChIKeyUAGKMMFZIGZKNS-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.32
Rot. Bonds4

About 5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine

5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine (PubChem CID 116976965) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine.

Molecular Properties

Compound Name5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine
PubChem CID116976965
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine
SMILESCNc1ncc(-c2ccc(OC)c(C(C)C)c2)cn1
InChIInChI=1S/C15H19N3O/c1-10(2)13-7-11(5-6-14(13)19-4)12-8-17-15(16-3)18-9-12/h5-10H,1-4H3,(H,16,17,18)
InChIKeyUAGKMMFZIGZKNS-UHFFFAOYSA-N
XLogP3.32
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 ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-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-(4-methoxy-3-propan-2-ylphenyl)-1H-pyrimidin-2-one
CID 82118050
4-(4-methoxy-3-propan-2-ylphenyl)-1H-pyrazole
CID 82113820
1-[5-(4-methoxy-3-propan-2-ylphenyl)-1H-imidazol-2-yl]-N-methylmethanamine
CID 95466155
5-(4-methoxyphenyl)-N-methylpyrimidin-2-amine
CID 116976946
5-(4-methoxy-3-propan-2-ylphenyl)-1H-imidazole
CID 82078805
5-(4-methoxy-3-propan-2-ylphenyl)-1,2-oxazole
CID 116868801
4-fluoro-1-methoxy-2-propan-2-ylbenzene
CID 53399241
5-(4-methoxy-2-propan-2-ylphenoxy)-2-N-methylpyrimidine-2,4-diamine
CID 145284551
5-(4-methoxy-3-propan-2-ylphenyl)-1,3-oxazole-2-carboxylic acid
CID 82049724
4-(4-methoxy-3-propan-2-ylphenyl)-6-methylpyrimidin-5-amine
CID 82483013
3-(4-methoxy-3-propan-2-ylphenyl)imidazo[1,5-a]pyridine
CID 116836487
2-(4-methoxy-3-propan-2-ylphenyl)-4-methyl-1,3-thiazol-5-ol
CID 116886031

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine?
The IUPAC name of 5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine (CID 116976965) is 5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine.
What is the SMILES notation for 5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine?
The canonical SMILES for 5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine is CNc1ncc(-c2ccc(OC)c(C(C)C)c2)cn1.
What is the InChIKey of 5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine?
The InChIKey is UAGKMMFZIGZKNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-10(2)13-7-11(5-6-14(13)19-4)12-8-17-15(16-3)18-9-12/h5-10H,1-4H3,(H,16,17,18).
What are the key properties of 5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine?
5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine has a molecular weight of 257.34 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxy-3-propan-2-ylphenyl)-N-methylpyrimidin-2-amine is sourced from PubChem (CID 116976965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).