6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine

C15H17ClN2O — CID 115474511

IUPAC6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine
SMILESCc1ccc(C(C)C)cc1Oc1nc(Cl)ccc1N
InChIInChI=1S/C15H17ClN2O/c1-9(2)11-5-4-10(3)13(8-11)19-15-12(17)6-7-14(16)18-15/h4-9H,17H2,1-3H3
InChIKeyJGYYLEMROQVYQW-UHFFFAOYSA-N
MW276.77 g/mol
LogP4.54
Rot. Bonds3

About 6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine

6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine (PubChem CID 115474511) has the molecular formula C15H17ClN2O and a molecular weight of 276.77 g/mol. Its IUPAC name is 6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine.

Molecular Properties

Compound Name6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine
PubChem CID115474511
Molecular FormulaC15H17ClN2O
Molecular Weight276.77 g/mol
Exact Mass276.10
IUPAC Name6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine
SMILESCc1ccc(C(C)C)cc1Oc1nc(Cl)ccc1N
InChIInChI=1S/C15H17ClN2O/c1-9(2)11-5-4-10(3)13(8-11)19-15-12(17)6-7-14(16)18-15/h4-9H,17H2,1-3H3
InChIKeyJGYYLEMROQVYQW-UHFFFAOYSA-N
XLogP4.54
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.77
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-(5-bromo-2-methylphenoxy)-6-chloropyridin-3-amine
CID 107283340
3,5-dichloro-6-(2-methyl-5-propan-2-ylphenoxy)pyridin-2-amine
CID 102760807
2,3,5-trichloro-6-(2-methyl-5-propan-2-ylphenoxy)pyridine
CID 102749594
6-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridin-3-amine
CID 115474420
2-methyl-4-(2-methyl-5-propan-2-ylphenoxy)aniline
CID 26190303
5-methyl-4-(2-methyl-5-propan-2-ylphenoxy)pyrimidin-2-amine
CID 80875224
5-methyl-6-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine
CID 62476910
2-chloro-4-(2-methyl-5-propan-2-ylphenoxy)pyrimidine
CID 62338137
5-amino-6-(2-methyl-5-propan-2-ylphenoxy)pyridine-3-carbonitrile
CID 103469664
5-chloro-N-methyl-4-(2-methyl-5-propan-2-ylphenoxy)pyrimidin-2-amine
CID 80874319
2-chloro-6-(2-methyl-5-propan-2-ylphenoxy)-7H-purine
CID 104786973
4-methyl-3-(4-propan-2-ylphenoxy)aniline
CID 155433623

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine?
The IUPAC name of 6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine (CID 115474511) is 6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine.
What is the SMILES notation for 6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine?
The canonical SMILES for 6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine is Cc1ccc(C(C)C)cc1Oc1nc(Cl)ccc1N.
What is the InChIKey of 6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine?
The InChIKey is JGYYLEMROQVYQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O/c1-9(2)11-5-4-10(3)13(8-11)19-15-12(17)6-7-14(16)18-15/h4-9H,17H2,1-3H3.
What are the key properties of 6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine?
6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine has a molecular weight of 276.77 g/mol, XLogP of 4.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(2-methyl-5-propan-2-ylphenoxy)pyridin-3-amine is sourced from PubChem (CID 115474511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).