2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol

C24H22N2O — CID 134141847

IUPAC2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol
SMILESCc1nc(N(c2ccccc2)c2ccc3ccccc3c2)c(C)c(C)c1O
InChIInChI=1S/C24H22N2O/c1-16-17(2)24(25-18(3)23(16)27)26(21-11-5-4-6-12-21)22-14-13-19-9-7-8-10-20(19)15-22/h4-15,27H,1-3H3
InChIKeyMXWLMUQEZHUEDR-UHFFFAOYSA-N
MW354.45 g/mol
LogP6.34
Rot. Bonds3

About 2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol

2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol (PubChem CID 134141847) has the molecular formula C24H22N2O and a molecular weight of 354.45 g/mol. Its IUPAC name is 2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol.

Molecular Properties

Compound Name2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol
PubChem CID134141847
Molecular FormulaC24H22N2O
Molecular Weight354.45 g/mol
Exact Mass354.17
IUPAC Name2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol
SMILESCc1nc(N(c2ccccc2)c2ccc3ccccc3c2)c(C)c(C)c1O
InChIInChI=1S/C24H22N2O/c1-16-17(2)24(25-18(3)23(16)27)26(21-11-5-4-6-12-21)22-14-13-19-9-7-8-10-20(19)15-22/h4-15,27H,1-3H3
InChIKeyMXWLMUQEZHUEDR-UHFFFAOYSA-N
XLogP6.34
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.45
LogP ≤ 56.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol?
The IUPAC name of 2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol (CID 134141847) is 2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol.
What is the SMILES notation for 2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol?
The canonical SMILES for 2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol is Cc1nc(N(c2ccccc2)c2ccc3ccccc3c2)c(C)c(C)c1O.
What is the InChIKey of 2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol?
The InChIKey is MXWLMUQEZHUEDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O/c1-16-17(2)24(25-18(3)23(16)27)26(21-11-5-4-6-12-21)22-14-13-19-9-7-8-10-20(19)15-22/h4-15,27H,1-3H3.
What are the key properties of 2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol?
2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol has a molecular weight of 354.45 g/mol, XLogP of 6.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethyl-6-(N-naphthalen-2-ylanilino)pyridin-3-ol is sourced from PubChem (CID 134141847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).