4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine

C16H19ClN2 — CID 142310931

IUPAC4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine
SMILESCc1nc(-c2ccc(Cl)cc2)cc(C(C)(C)C)c1N
InChIInChI=1S/C16H19ClN2/c1-10-15(18)13(16(2,3)4)9-14(19-10)11-5-7-12(17)8-6-11/h5-9H,18H2,1-4H3
InChIKeyFIFWHNPFMJDMRT-UHFFFAOYSA-N
MW274.80 g/mol
LogP4.59
Rot. Bonds1

About 4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine

4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine (PubChem CID 142310931) has the molecular formula C16H19ClN2 and a molecular weight of 274.80 g/mol. Its IUPAC name is 4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine.

Molecular Properties

Compound Name4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine
PubChem CID142310931
Molecular FormulaC16H19ClN2
Molecular Weight274.80 g/mol
Exact Mass274.12
IUPAC Name4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine
SMILESCc1nc(-c2ccc(Cl)cc2)cc(C(C)(C)C)c1N
InChIInChI=1S/C16H19ClN2/c1-10-15(18)13(16(2,3)4)9-14(19-10)11-5-7-12(17)8-6-11/h5-9H,18H2,1-4H3
InChIKeyFIFWHNPFMJDMRT-UHFFFAOYSA-N
XLogP4.59
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.80
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine?
The IUPAC name of 4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine (CID 142310931) is 4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine.
What is the SMILES notation for 4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine?
The canonical SMILES for 4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine is Cc1nc(-c2ccc(Cl)cc2)cc(C(C)(C)C)c1N.
What is the InChIKey of 4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine?
The InChIKey is FIFWHNPFMJDMRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN2/c1-10-15(18)13(16(2,3)4)9-14(19-10)11-5-7-12(17)8-6-11/h5-9H,18H2,1-4H3.
What are the key properties of 4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine?
4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine has a molecular weight of 274.80 g/mol, XLogP of 4.59, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-6-(4-chlorophenyl)-2-methylpyridin-3-amine is sourced from PubChem (CID 142310931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).