2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine

C22H24N2O2 — CID 166900156

IUPAC2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine
SMILESCC(C)Nc1ccc(OCc2ccccc2)nc1OCc1ccccc1
InChIInChI=1S/C22H24N2O2/c1-17(2)23-20-13-14-21(25-15-18-9-5-3-6-10-18)24-22(20)26-16-19-11-7-4-8-12-19/h3-14,17,23H,15-16H2,1-2H3
InChIKeyODLAKQCHQCOSCF-UHFFFAOYSA-N
MW348.45 g/mol
LogP5.06
Rot. Bonds8

About 2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine

2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine (PubChem CID 166900156) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine.

Molecular Properties

Compound Name2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine
PubChem CID166900156
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC Name2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine
SMILESCC(C)Nc1ccc(OCc2ccccc2)nc1OCc1ccccc1
InChIInChI=1S/C22H24N2O2/c1-17(2)23-20-13-14-21(25-15-18-9-5-3-6-10-18)24-22(20)26-16-19-11-7-4-8-12-19/h3-14,17,23H,15-16H2,1-2H3
InChIKeyODLAKQCHQCOSCF-UHFFFAOYSA-N
XLogP5.06
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.45
LogP ≤ 55.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine?
The IUPAC name of 2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine (CID 166900156) is 2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine.
What is the SMILES notation for 2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine?
The canonical SMILES for 2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine is CC(C)Nc1ccc(OCc2ccccc2)nc1OCc1ccccc1.
What is the InChIKey of 2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine?
The InChIKey is ODLAKQCHQCOSCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-17(2)23-20-13-14-21(25-15-18-9-5-3-6-10-18)24-22(20)26-16-19-11-7-4-8-12-19/h3-14,17,23H,15-16H2,1-2H3.
What are the key properties of 2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine?
2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine has a molecular weight of 348.45 g/mol, XLogP of 5.06, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(phenylmethoxy)-N-propan-2-ylpyridin-3-amine is sourced from PubChem (CID 166900156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).