1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene

C18H20O2 — CID 6482553

IUPAC1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene
SMILESCOc1ccc(COc2ccc(CC3CC3)cc2)cc1
InChIInChI=1S/C18H20O2/c1-19-17-8-6-16(7-9-17)13-20-18-10-4-15(5-11-18)12-14-2-3-14/h4-11,14H,2-3,12-13H2,1H3
InChIKeyOEFFCSWNIBGWQO-UHFFFAOYSA-N
MW268.36 g/mol
LogP4.23
Rot. Bonds6

About 1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene

1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene (PubChem CID 6482553) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene
PubChem CID6482553
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene
SMILESCOc1ccc(COc2ccc(CC3CC3)cc2)cc1
InChIInChI=1S/C18H20O2/c1-19-17-8-6-16(7-9-17)13-20-18-10-4-15(5-11-18)12-14-2-3-14/h4-11,14H,2-3,12-13H2,1H3
InChIKeyOEFFCSWNIBGWQO-UHFFFAOYSA-N
XLogP4.23
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene?
The IUPAC name of 1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene (CID 6482553) is 1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene.
What is the SMILES notation for 1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene?
The canonical SMILES for 1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene is COc1ccc(COc2ccc(CC3CC3)cc2)cc1.
What is the InChIKey of 1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene?
The InChIKey is OEFFCSWNIBGWQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c1-19-17-8-6-16(7-9-17)13-20-18-10-4-15(5-11-18)12-14-2-3-14/h4-11,14H,2-3,12-13H2,1H3.
What are the key properties of 1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene?
1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene has a molecular weight of 268.36 g/mol, XLogP of 4.23, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-4-[(4-methoxyphenyl)methoxy]benzene is sourced from PubChem (CID 6482553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).