1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine

C19H24N2O4 — CID 169386244

IUPAC1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine
SMILESCOc1cccc(CNNc2ccccc2)c1OCCC1OCCO1
InChIInChI=1S/C19H24N2O4/c1-22-17-9-5-6-15(14-20-21-16-7-3-2-4-8-16)19(17)25-11-10-18-23-12-13-24-18/h2-9,18,20-21H,10-14H2,1H3
InChIKeyKKLIRTHBJGVPRL-UHFFFAOYSA-N
MW344.41 g/mol
LogP2.95
Rot. Bonds9

About 1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine

1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine (PubChem CID 169386244) has the molecular formula C19H24N2O4 and a molecular weight of 344.41 g/mol. Its IUPAC name is 1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine.

Molecular Properties

Compound Name1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine
PubChem CID169386244
Molecular FormulaC19H24N2O4
Molecular Weight344.41 g/mol
Exact Mass344.17
IUPAC Name1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine
SMILESCOc1cccc(CNNc2ccccc2)c1OCCC1OCCO1
InChIInChI=1S/C19H24N2O4/c1-22-17-9-5-6-15(14-20-21-16-7-3-2-4-8-16)19(17)25-11-10-18-23-12-13-24-18/h2-9,18,20-21H,10-14H2,1H3
InChIKeyKKLIRTHBJGVPRL-UHFFFAOYSA-N
XLogP2.95
TPSA60.98 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[2-(2,6-dimethoxyphenoxy)ethyl]-1,3-dioxane
CID 66473547
N-[(2-ethoxy-3-methoxyphenyl)methyl]aniline
CID 18778335
benzyl N'-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methylideneamino]carbamimidothioate
CID 168612866
2-[2-(ethylaminomethyl)-6-methoxyphenoxy]ethanol
CID 43471970
N-[[3-methoxy-2-(2-methoxyethoxy)phenyl]methyl]ethanamine
CID 43471950
2-[2-(2,6-dichlorophenoxy)ethyl]-1,3-dioxolane
CID 82091052
N-[(2-butoxy-3-methoxyphenyl)methyl]-1-(oxolan-2-yl)methanamine
CID 54847592
4-[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]-6-methyl-2-oxo-1H-pyridine-3-carbonitrile
CID 168586409
N-[[2-(2-fluoroethoxy)-3-methoxyphenyl]methyl]cyclopropanamine
CID 80698601
1-[2-[(cyclopropylamino)methyl]-6-methoxyphenoxy]-3-methoxypropan-2-ol
CID 63931067
2-[[3-methoxy-2-(3-phenylpropoxy)phenyl]methylamino]ethanol
CID 92928362
N-[(3-methoxy-2-phenylmethoxyphenyl)methyl]-1-[(2S)-oxolan-2-yl]methanamine
CID 7248431

Frequently Asked Questions

What is the IUPAC name of 1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine?
The IUPAC name of 1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine (CID 169386244) is 1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine.
What is the SMILES notation for 1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine?
The canonical SMILES for 1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine is COc1cccc(CNNc2ccccc2)c1OCCC1OCCO1.
What is the InChIKey of 1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine?
The InChIKey is KKLIRTHBJGVPRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4/c1-22-17-9-5-6-15(14-20-21-16-7-3-2-4-8-16)19(17)25-11-10-18-23-12-13-24-18/h2-9,18,20-21H,10-14H2,1H3.
What are the key properties of 1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine?
1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine has a molecular weight of 344.41 g/mol, XLogP of 2.95, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-[2-(1,3-dioxolan-2-yl)ethoxy]-3-methoxyphenyl]methyl]-2-phenylhydrazine is sourced from PubChem (CID 169386244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).