(2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide

C27H37NO2 — CID 145097731

IUPAC(2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide
SMILESCCCC(C)(C)C(/C=C/C(C)=C/C=C/C(C)=C/C(=O)Nc1ccc(O)cc1)=C(C)C
InChIInChI=1S/C27H37NO2/c1-8-18-27(6,7)25(20(2)3)17-12-21(4)10-9-11-22(5)19-26(30)28-23-13-15-24(29)16-14-23/h9-17,19,29H,8,18H2,1-7H3,(H,28,30)/b11-9+,17-12+,21-10+,22-19+
InChIKeyJEZSKZUHAKIMIB-CPGOKQLMSA-N
MW407.60 g/mol
LogP7.50
Rot. Bonds9

About (2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide

(2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide (PubChem CID 145097731) has the molecular formula C27H37NO2 and a molecular weight of 407.60 g/mol. Its IUPAC name is (2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide.

Molecular Properties

Compound Name(2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide
PubChem CID145097731
Molecular FormulaC27H37NO2
Molecular Weight407.60 g/mol
Exact Mass407.28
IUPAC Name(2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide
SMILESCCCC(C)(C)C(/C=C/C(C)=C/C=C/C(C)=C/C(=O)Nc1ccc(O)cc1)=C(C)C
InChIInChI=1S/C27H37NO2/c1-8-18-27(6,7)25(20(2)3)17-12-21(4)10-9-11-22(5)19-26(30)28-23-13-15-24(29)16-14-23/h9-17,19,29H,8,18H2,1-7H3,(H,28,30)/b11-9+,17-12+,21-10+,22-19+
InChIKeyJEZSKZUHAKIMIB-CPGOKQLMSA-N
XLogP7.50
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500407.60
LogP ≤ 57.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2E,4E,6E,8E,10E)-N-(4-hydroxyphenyl)-3,7,11-trimethyl-10-propan-2-ylpentadeca-2,4,6,8,10-pentaenamide
CID 89259061
3,7,11,11-tetramethyl-10-propan-2-ylidenetrideca-2,4,6,8-tetraenoic acid
CID 54362744
N-(4-hydroxyphenyl)-2-oxoacetamide
CID 22743962
(E)-N,N'-bis(4-hydroxyphenyl)but-2-enediamide
CID 5356642
N-(4-dodecoxyphenyl)-3-(4-hydroxyphenyl)but-2-enamide
CID 54488959
N'-(4-hydroxyphenyl)but-2-enediamide
CID 54373747
(2E,4E,6E,8E)-N-(4-methoxyphenyl)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenamide
CID 6385696
ethyl 4-[[(2E,4E,6E,8Z)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoyl]amino]benzoate
CID 124519039
4-[18-(4-hydroxyphenyl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]phenol
CID 76584556
N-(4-hydroxyphenyl)-4-oxobut-2-enamide
CID 54364217
(2E,4Z,6Z,8E)-8-(3,4-dihydro-2H-naphthalen-1-ylidene)-3,7-dimethylocta-2,4,6-trienoic acid;4-[[(Z,4E)-4-(3,4-dihydro-2H-naphthalen-1-ylidene)-3-methylbut-2-enoyl]amino]benzoic acid
CID 161367008
[4-[[3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoyl]amino]phenyl] propyl hydrogen phosphate
CID 91275637

Frequently Asked Questions

What is the IUPAC name of (2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide?
The IUPAC name of (2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide (CID 145097731) is (2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide.
What is the SMILES notation for (2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide?
The canonical SMILES for (2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide is CCCC(C)(C)C(/C=C/C(C)=C/C=C/C(C)=C/C(=O)Nc1ccc(O)cc1)=C(C)C.
What is the InChIKey of (2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide?
The InChIKey is JEZSKZUHAKIMIB-CPGOKQLMSA-N. The full InChI is InChI=1S/C27H37NO2/c1-8-18-27(6,7)25(20(2)3)17-12-21(4)10-9-11-22(5)19-26(30)28-23-13-15-24(29)16-14-23/h9-17,19,29H,8,18H2,1-7H3,(H,28,30)/b11-9+,17-12+,21-10+,22-19+.
What are the key properties of (2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide?
(2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide has a molecular weight of 407.60 g/mol, XLogP of 7.50, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E,6E,8E)-N-(4-hydroxyphenyl)-3,7,11,11-tetramethyl-10-propan-2-ylidenetetradeca-2,4,6,8-tetraenamide is sourced from PubChem (CID 145097731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).