4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol

C22H24N2O3 — CID 137304185

IUPAC4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol
SMILESCCOc1ccccc1-c1cc(NCCOC)nc(-c2ccc(O)cc2)c1
InChIInChI=1S/C22H24N2O3/c1-3-27-21-7-5-4-6-19(21)17-14-20(16-8-10-18(25)11-9-16)24-22(15-17)23-12-13-26-2/h4-11,14-15,25H,3,12-13H2,1-2H3,(H,23,24)
InChIKeyTYINYBYDQCFRPA-UHFFFAOYSA-N
MW364.45 g/mol
LogP4.58
Rot. Bonds8

About 4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol

4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol (PubChem CID 137304185) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is 4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol.

Molecular Properties

Compound Name4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol
PubChem CID137304185
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC Name4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol
SMILESCCOc1ccccc1-c1cc(NCCOC)nc(-c2ccc(O)cc2)c1
InChIInChI=1S/C22H24N2O3/c1-3-27-21-7-5-4-6-19(21)17-14-20(16-8-10-18(25)11-9-16)24-22(15-17)23-12-13-26-2/h4-11,14-15,25H,3,12-13H2,1-2H3,(H,23,24)
InChIKeyTYINYBYDQCFRPA-UHFFFAOYSA-N
XLogP4.58
TPSA63.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 54.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(2-ethoxyphenyl)phenol
CID 83129672
2-N-(4-ethoxyphenyl)-4-N-(2-methoxyethyl)-6-phenylpyrimidine-2,4-diamine
CID 112934938
2-cyclopropyl-6-(2-ethoxyphenyl)-N-ethylpyrimidin-4-amine
CID 80949016
4-[6-(butan-2-ylamino)-4-(2-prop-2-enoxyphenyl)-2-pyridinyl]-2-methoxyphenol
CID 137306969
4-N-(2-methoxyethyl)-6-phenyl-2-N-propan-2-ylpyrimidine-2,4-diamine
CID 112932787
6-ethoxy-N-(2-methoxyethyl)-2-(methoxymethyl)pyrimidin-4-amine
CID 82456633
4-(2-amino-4-ethoxypteridin-6-yl)phenol;4-ethoxy-6-(2-ethoxyphenyl)pteridin-2-amine
CID 160631661
6-[2-(2-methoxyethoxy)phenyl]-N-propylpyrimidin-4-amine
CID 104663227
1-ethoxy-2-[4-(4-phenylphenyl)phenyl]benzene
CID 151505413
2-N-(4-ethoxyphenyl)-4-N-(3-methoxypropyl)-6-phenylpyrimidine-2,4-diamine
CID 112935216
2-amino-4-(2-ethoxyphenyl)-6-(4-methoxyphenyl)pyridine-3-carbonitrile
CID 3371240
3-[6-(2-methoxyethylamino)-1H-pyrrolo[2,3-b]pyridin-4-yl]phenol
CID 56909607

Frequently Asked Questions

What is the IUPAC name of 4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol?
The IUPAC name of 4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol (CID 137304185) is 4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol.
What is the SMILES notation for 4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol?
The canonical SMILES for 4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol is CCOc1ccccc1-c1cc(NCCOC)nc(-c2ccc(O)cc2)c1.
What is the InChIKey of 4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol?
The InChIKey is TYINYBYDQCFRPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c1-3-27-21-7-5-4-6-19(21)17-14-20(16-8-10-18(25)11-9-16)24-22(15-17)23-12-13-26-2/h4-11,14-15,25H,3,12-13H2,1-2H3,(H,23,24).
What are the key properties of 4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol?
4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol has a molecular weight of 364.45 g/mol, XLogP of 4.58, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(2-ethoxyphenyl)-6-(2-methoxyethylamino)-2-pyridinyl]phenol is sourced from PubChem (CID 137304185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).