potassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide

C23H30KNO — CID 143602757

IUPACpotassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide
SMILESC=Cc1ccc(COCC(C)(C)CC(C)(C)[N-]c2ccccc2)cc1.[K+]
InChIInChI=1S/C23H30NO.K/c1-6-19-12-14-20(15-13-19)16-25-18-22(2,3)17-23(4,5)24-21-10-8-7-9-11-21;/h6-15H,1,16-18H2,2-5H3;/q-1;+1
InChIKeyQTHBHMGSMLSLMS-UHFFFAOYSA-N
MW375.60 g/mol
LogP3.75
Rot. Bonds9

About potassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide

potassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide (PubChem CID 143602757) has the molecular formula C23H30KNO and a molecular weight of 375.60 g/mol. Its IUPAC name is potassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide.

Molecular Properties

Compound Namepotassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide
PubChem CID143602757
Molecular FormulaC23H30KNO
Molecular Weight375.60 g/mol
Exact Mass375.20
IUPAC Namepotassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide
SMILESC=Cc1ccc(COCC(C)(C)CC(C)(C)[N-]c2ccccc2)cc1.[K+]
InChIInChI=1S/C23H30NO.K/c1-6-19-12-14-20(15-13-19)16-25-18-22(2,3)17-23(4,5)24-21-10-8-7-9-11-21;/h6-15H,1,16-18H2,2-5H3;/q-1;+1
InChIKeyQTHBHMGSMLSLMS-UHFFFAOYSA-N
XLogP3.75
TPSA23.33 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.60
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze potassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide 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

[2,2-bis(diphenylphosphanylmethyl)-3-[(4-ethenylphenyl)methoxy]propyl]-diphenylphosphane
CID 101101962
N-[2-[(4-ethenylphenyl)methoxy]ethyl]aniline
CID 58421196
1-ethenyl-4-[2-[2-[2-[2-[(4-ethenylphenyl)methoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]benzene
CID 10550369
1-ethenyl-4-(phenylmethoxymethoxy)benzene
CID 54554930
1-ethenyl-4-(pentoxymethyl)benzene
CID 12541564
(4-ethenylphenyl)methoxymethylsilane
CID 159198884
N-[2-[(4-ethenylphenyl)methoxy]ethyl]-N,2-dimethylpropan-2-amine
CID 118177639
3,3-dimethyl-4-phenylmethoxybutan-1-amine
CID 122238724
1-ethenyl-4-[2-(2-propoxyethoxy)ethoxymethyl]benzene
CID 123157384
(3S)-2,2-dimethyl-1-phenylmethoxyhex-5-en-3-ol
CID 53362755
[2-ethenyl-2,4-diethyl-4-(phenylmethoxymethyl)hex-5-enoxy]methylbenzene
CID 11632573
2-fluoro-2-methyl-3-phenylmethoxypropanal
CID 14267601

Frequently Asked Questions

What is the IUPAC name of potassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide?
The IUPAC name of potassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide (CID 143602757) is potassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide.
What is the SMILES notation for potassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide?
The canonical SMILES for potassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide is C=Cc1ccc(COCC(C)(C)CC(C)(C)[N-]c2ccccc2)cc1.[K+].
What is the InChIKey of potassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide?
The InChIKey is QTHBHMGSMLSLMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30NO.K/c1-6-19-12-14-20(15-13-19)16-25-18-22(2,3)17-23(4,5)24-21-10-8-7-9-11-21;/h6-15H,1,16-18H2,2-5H3;/q-1;+1.
What are the key properties of potassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide?
potassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide has a molecular weight of 375.60 g/mol, XLogP of 3.75, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium [5-[(4-ethenylphenyl)methoxy]-2,4,4-trimethylpentan-2-yl]-phenylazanide is sourced from PubChem (CID 143602757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).