1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene

C23H22O2 — CID 67587643

IUPAC1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene
SMILESCOc1ccccc1COc1cccc(C2CC2c2ccccc2)c1
InChIInChI=1S/C23H22O2/c1-24-23-13-6-5-10-19(23)16-25-20-12-7-11-18(14-20)22-15-21(22)17-8-3-2-4-9-17/h2-14,21-22H,15-16H2,1H3
InChIKeyPVZACOHJCZTJTI-UHFFFAOYSA-N
MW330.43 g/mol
LogP5.55
Rot. Bonds6

About 1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene

1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene (PubChem CID 67587643) has the molecular formula C23H22O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is 1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene.

Molecular Properties

Compound Name1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene
PubChem CID67587643
Molecular FormulaC23H22O2
Molecular Weight330.43 g/mol
Exact Mass330.16
IUPAC Name1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene
SMILESCOc1ccccc1COc1cccc(C2CC2c2ccccc2)c1
InChIInChI=1S/C23H22O2/c1-24-23-13-6-5-10-19(23)16-25-20-12-7-11-18(14-20)22-15-21(22)17-8-3-2-4-9-17/h2-14,21-22H,15-16H2,1H3
InChIKeyPVZACOHJCZTJTI-UHFFFAOYSA-N
XLogP5.55
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.43
LogP ≤ 55.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(E)-3-methoxy-2-[2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]phenyl]prop-2-enoic acid
CID 70271488
1-ethyl-3-[(2-methoxyphenyl)methoxy]benzene
CID 60656964
2-[3-[(2-methoxyphenyl)methoxy]phenoxy]ethanamine
CID 58027581
N-[(2-methoxyphenyl)methyl]-3-phenylmethoxyaniline
CID 54801294
2-methoxyimino-2-[2-[[3-(2-thiophen-2-ylcyclopropyl)phenoxy]methyl]phenyl]acetic acid
CID 140990732
4-[(2-methoxyphenyl)methoxy]-1-methylpyrazole
CID 116794197
1-[3-[(2-methoxyphenyl)methoxy]phenyl]butan-1-ol
CID 69097467
1-bromo-4-[(2-methoxyphenyl)methoxy]benzene
CID 54940328
2-[2-[3-[(2-methoxyphenyl)methoxy]phenoxy]ethyl]isoindole-1,3-dione
CID 67316681
2-[(2-methoxyphenyl)methoxy]-1,3-dimethylbenzene
CID 70895147
[4-[(2-methoxyphenyl)methoxy]phenyl]methanol
CID 54940415
4-bromo-2-methoxy-1-(phenoxymethyl)benzene
CID 117219523

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene?
The IUPAC name of 1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene (CID 67587643) is 1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene.
What is the SMILES notation for 1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene?
The canonical SMILES for 1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene is COc1ccccc1COc1cccc(C2CC2c2ccccc2)c1.
What is the InChIKey of 1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene?
The InChIKey is PVZACOHJCZTJTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22O2/c1-24-23-13-6-5-10-19(23)16-25-20-12-7-11-18(14-20)22-15-21(22)17-8-3-2-4-9-17/h2-14,21-22H,15-16H2,1H3.
What are the key properties of 1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene?
1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene has a molecular weight of 330.43 g/mol, XLogP of 5.55, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-[[3-(2-phenylcyclopropyl)phenoxy]methyl]benzene is sourced from PubChem (CID 67587643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).