(E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide

C15H14N2O2 — CID 84553243

IUPAC(E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide
SMILESCc1cccnc1NC(=O)/C=C/c1ccc(O)cc1
InChIInChI=1S/C15H14N2O2/c1-11-3-2-10-16-15(11)17-14(19)9-6-12-4-7-13(18)8-5-12/h2-10,18H,1H3,(H,16,17,19)/b9-6+
InChIKeyWEUDXPQVXXLCFO-RMKNXTFCSA-N
MW254.29 g/mol
LogP2.75
Rot. Bonds3

About (E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide

(E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide (PubChem CID 84553243) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is (E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide.

Molecular Properties

Compound Name(E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide
PubChem CID84553243
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name(E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide
SMILESCc1cccnc1NC(=O)/C=C/c1ccc(O)cc1
InChIInChI=1S/C15H14N2O2/c1-11-3-2-10-16-15(11)17-14(19)9-6-12-4-7-13(18)8-5-12/h2-10,18H,1H3,(H,16,17,19)/b9-6+
InChIKeyWEUDXPQVXXLCFO-RMKNXTFCSA-N
XLogP2.75
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

3-(4-tert-butylphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide
CID 3700792
(E)-3-(3-fluorophenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide
CID 84554139
N-(4-hydroxyphenyl)-N'-(3-methyl-2-pyridinyl)oxamide
CID 44997063
N-(3-methyl-2-pyridinyl)prop-2-enamide
CID 43616345
2-[3-(3,4-dimethylphenyl)prop-2-enoylamino]pyridine-3-carboxylic acid
CID 91422896
3-[3-methoxy-4-(2-methylpropoxy)phenyl]-N-(3-methyl-2-pyridinyl)prop-2-enamide
CID 154762797
4-[(E)-3,3-dimethylbut-1-enyl]-N-(3-methyl-2-pyridinyl)benzamide
CID 11403664
(E)-3-(4-fluorophenyl)-N-(2-methyl-3-pyridinyl)prop-2-enamide
CID 75408108
(E)-3-[4-[(3-methyl-2-pyridinyl)sulfamoyl]phenyl]prop-2-enoic acid
CID 6217942
(E)-N-(3-bromo-4-methylphenyl)-3-(4-hydroxyphenyl)prop-2-enamide
CID 84552549
(E)-N-(5-iodo-3-methyl-2-pyridinyl)-3-phenylprop-2-enamide
CID 17374734
1-methyl-3-(3-methyl-2-pyridinyl)urea
CID 17171367

Frequently Asked Questions

What is the IUPAC name of (E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide?
The IUPAC name of (E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide (CID 84553243) is (E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide.
What is the SMILES notation for (E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide?
The canonical SMILES for (E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide is Cc1cccnc1NC(=O)/C=C/c1ccc(O)cc1.
What is the InChIKey of (E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide?
The InChIKey is WEUDXPQVXXLCFO-RMKNXTFCSA-N. The full InChI is InChI=1S/C15H14N2O2/c1-11-3-2-10-16-15(11)17-14(19)9-6-12-4-7-13(18)8-5-12/h2-10,18H,1H3,(H,16,17,19)/b9-6+.
What are the key properties of (E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide?
(E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide has a molecular weight of 254.29 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(4-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)prop-2-enamide is sourced from PubChem (CID 84553243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).