3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine

C17H22N2O — CID 103183024

IUPAC3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine
SMILESCc1cnc(COc2ccccc2C(C)C)c(C)c1N
InChIInChI=1S/C17H22N2O/c1-11(2)14-7-5-6-8-16(14)20-10-15-13(4)17(18)12(3)9-19-15/h5-9,11H,10H2,1-4H3,(H2,18,19)
InChIKeyFSVHWIAUOCJVEV-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.98
Rot. Bonds4

About 3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine

3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine (PubChem CID 103183024) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine.

Molecular Properties

Compound Name3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine
PubChem CID103183024
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine
SMILESCc1cnc(COc2ccccc2C(C)C)c(C)c1N
InChIInChI=1S/C17H22N2O/c1-11(2)14-7-5-6-8-16(14)20-10-15-13(4)17(18)12(3)9-19-15/h5-9,11H,10H2,1-4H3,(H2,18,19)
InChIKeyFSVHWIAUOCJVEV-UHFFFAOYSA-N
XLogP3.98
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-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

3,5-dimethyl-2-(1-phenylethoxymethyl)pyridin-4-amine
CID 103183068
3-methyl-2-[(2-propan-2-ylphenoxy)methyl]pyridine
CID 112651495
3,5-dimethyl-2-(naphthalen-2-yloxymethyl)pyridin-4-amine
CID 103183022
2-[(4-fluorophenoxy)methyl]-3,5-dimethylpyridin-4-amine
CID 103183013
3,5-dimethyl-2-(2-methylpropoxymethyl)pyridin-4-amine
CID 103183038
2-[(4-methoxyphenoxy)methyl]-3,5-dimethylpyridin-4-amine
CID 103183021
3,5-dimethyl-2-(4-methylpentoxymethyl)pyridin-4-amine
CID 103183115
2-methyl-6-[(2-propan-2-ylphenoxy)methyl]pyridine
CID 79260812
3,4-dimethoxy-2-[(2-propan-2-ylphenoxy)methyl]pyridine
CID 103174172
4-methyl-2-[(2-propan-2-ylphenoxy)methyl]-1H-benzimidazole
CID 46264650
2-chloro-5-[(2-propan-2-ylphenoxy)methyl]-1,3-thiazole
CID 79765645
5-[(2-propan-2-ylphenoxy)methyl]-1,3-thiazole
CID 112644779

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine?
The IUPAC name of 3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine (CID 103183024) is 3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine.
What is the SMILES notation for 3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine?
The canonical SMILES for 3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine is Cc1cnc(COc2ccccc2C(C)C)c(C)c1N.
What is the InChIKey of 3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine?
The InChIKey is FSVHWIAUOCJVEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-11(2)14-7-5-6-8-16(14)20-10-15-13(4)17(18)12(3)9-19-15/h5-9,11H,10H2,1-4H3,(H2,18,19).
What are the key properties of 3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine?
3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine has a molecular weight of 270.38 g/mol, XLogP of 3.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-2-[(2-propan-2-ylphenoxy)methyl]pyridin-4-amine is sourced from PubChem (CID 103183024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).