6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine

C25H30N2 — CID 24744414

IUPAC6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine
SMILESCc1cccc(C)c1-c1cccc(Nc2c(C(C)C)cccc2C(C)C)n1
InChIInChI=1S/C25H30N2/c1-16(2)20-12-8-13-21(17(3)4)25(20)27-23-15-9-14-22(26-23)24-18(5)10-7-11-19(24)6/h7-17H,1-6H3,(H,26,27)
InChIKeyUWZJQFOODLGVBS-UHFFFAOYSA-N
MW358.53 g/mol
LogP7.36
Rot. Bonds5

About 6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine

6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine (PubChem CID 24744414) has the molecular formula C25H30N2 and a molecular weight of 358.53 g/mol. Its IUPAC name is 6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine.

Molecular Properties

Compound Name6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine
PubChem CID24744414
Molecular FormulaC25H30N2
Molecular Weight358.53 g/mol
Exact Mass358.24
IUPAC Name6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine
SMILESCc1cccc(C)c1-c1cccc(Nc2c(C(C)C)cccc2C(C)C)n1
InChIInChI=1S/C25H30N2/c1-16(2)20-12-8-13-21(17(3)4)25(20)27-23-15-9-14-22(26-23)24-18(5)10-7-11-19(24)6/h7-17H,1-6H3,(H,26,27)
InChIKeyUWZJQFOODLGVBS-UHFFFAOYSA-N
XLogP7.36
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.53
LogP ≤ 57.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine?
The IUPAC name of 6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine (CID 24744414) is 6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine.
What is the SMILES notation for 6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine?
The canonical SMILES for 6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine is Cc1cccc(C)c1-c1cccc(Nc2c(C(C)C)cccc2C(C)C)n1.
What is the InChIKey of 6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine?
The InChIKey is UWZJQFOODLGVBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N2/c1-16(2)20-12-8-13-21(17(3)4)25(20)27-23-15-9-14-22(26-23)24-18(5)10-7-11-19(24)6/h7-17H,1-6H3,(H,26,27).
What are the key properties of 6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine?
6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine has a molecular weight of 358.53 g/mol, XLogP of 7.36, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,6-dimethylphenyl)-N-[2,6-di(propan-2-yl)phenyl]pyridin-2-amine is sourced from PubChem (CID 24744414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).