(2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide

C20H23NO2 — CID 15416264

IUPAC(2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide
SMILESCC(C)CNC(=O)/C=C/C=C\C(O)c1ccc2ccccc2c1
InChIInChI=1S/C20H23NO2/c1-15(2)14-21-20(23)10-6-5-9-19(22)18-12-11-16-7-3-4-8-17(16)13-18/h3-13,15,19,22H,14H2,1-2H3,(H,21,23)/b9-5-,10-6+
InChIKeyQAYRIPZGWLXCFP-VTBWALSUSA-N
MW309.41 g/mol
LogP3.76
Rot. Bonds6

About (2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide

(2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide (PubChem CID 15416264) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is (2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide.

Molecular Properties

Compound Name(2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide
PubChem CID15416264
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Name(2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide
SMILESCC(C)CNC(=O)/C=C/C=C\C(O)c1ccc2ccccc2c1
InChIInChI=1S/C20H23NO2/c1-15(2)14-21-20(23)10-6-5-9-19(22)18-12-11-16-7-3-4-8-17(16)13-18/h3-13,15,19,22H,14H2,1-2H3,(H,21,23)/b9-5-,10-6+
InChIKeyQAYRIPZGWLXCFP-VTBWALSUSA-N
XLogP3.76
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2E,4E)-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide
CID 13477078
(2E,4E)-N-(2-methylpropyl)-8-naphthalen-2-ylocta-2,4-dienamide
CID 88635219
(2E,4E)-N-(2-methylpropyl)-6-phenylhexa-2,4-dienamide
CID 5281870
(2E,4Z)-6-hydroxy-7-methyl-N-(2-methylpropyl)octa-2,4-dienamide
CID 15416267
N-(2-hydroxy-2-naphthalen-2-ylethyl)-2-methylpropanamide
CID 111112159
(2E,4E)-N-(2-methylpropyl)-6-oxohepta-2,4-dienamide
CID 25195169
(2E,4E)-N-(2-methylpropyl)-11-naphthalen-1-yloxyundeca-2,4-dienamide
CID 88665225
9-(7-fluoronaphthalen-1-yl)oxy-N-(2-methylpropyl)nona-2,4-dienamide
CID 173408172
N-[(1S)-1-naphthalen-2-ylethyl]prop-2-enamide
CID 101382734
N-(2-methylpropyl)-9-phenylnona-2,4-dienamide
CID 90802349
(2E)-7-(2-methylphenyl)-N-(2-methylpropyl)hepta-2,4-dienamide
CID 88614180
acetic acid;1-naphthalen-2-ylprop-2-en-1-ol
CID 70153213

Frequently Asked Questions

What is the IUPAC name of (2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide?
The IUPAC name of (2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide (CID 15416264) is (2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide.
What is the SMILES notation for (2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide?
The canonical SMILES for (2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide is CC(C)CNC(=O)/C=C/C=C\C(O)c1ccc2ccccc2c1.
What is the InChIKey of (2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide?
The InChIKey is QAYRIPZGWLXCFP-VTBWALSUSA-N. The full InChI is InChI=1S/C20H23NO2/c1-15(2)14-21-20(23)10-6-5-9-19(22)18-12-11-16-7-3-4-8-17(16)13-18/h3-13,15,19,22H,14H2,1-2H3,(H,21,23)/b9-5-,10-6+.
What are the key properties of (2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide?
(2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide has a molecular weight of 309.41 g/mol, XLogP of 3.76, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4Z)-6-hydroxy-N-(2-methylpropyl)-6-naphthalen-2-ylhexa-2,4-dienamide is sourced from PubChem (CID 15416264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).