1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene

C21H24O2 — CID 175031556

IUPAC1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene
SMILESCC(C)(c1ccc(OC2CC2)cc1)c1ccc(OC2CC2)cc1
InChIInChI=1S/C21H24O2/c1-21(2,15-3-7-17(8-4-15)22-19-11-12-19)16-5-9-18(10-6-16)23-20-13-14-20/h3-10,19-20H,11-14H2,1-2H3
InChIKeyXADZCGCKYJWFAS-UHFFFAOYSA-N
MW308.42 g/mol
LogP5.09
Rot. Bonds6

About 1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene

1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene (PubChem CID 175031556) has the molecular formula C21H24O2 and a molecular weight of 308.42 g/mol. Its IUPAC name is 1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene.

Molecular Properties

Compound Name1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene
PubChem CID175031556
Molecular FormulaC21H24O2
Molecular Weight308.42 g/mol
Exact Mass308.18
IUPAC Name1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene
SMILESCC(C)(c1ccc(OC2CC2)cc1)c1ccc(OC2CC2)cc1
InChIInChI=1S/C21H24O2/c1-21(2,15-3-7-17(8-4-15)22-19-11-12-19)16-5-9-18(10-6-16)23-20-13-14-20/h3-10,19-20H,11-14H2,1-2H3
InChIKeyXADZCGCKYJWFAS-UHFFFAOYSA-N
XLogP5.09
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.42
LogP ≤ 55.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-tert-butyl-4-cyclohexyloxybenzene
CID 10466491
2-[4-[2-[4-(oxetan-2-yloxy)phenyl]propan-2-yl]phenoxy]oxetane
CID 70479359
4-[1-(4-cyclopropyloxyphenyl)-1-hydroxyethyl]phenol
CID 114518723
1-tert-butyl-4-(4-ethylcyclohexyl)oxybenzene
CID 64764201
3-(4-cyclopropyloxyphenyl)-3-methylbutan-1-amine
CID 114520455
1-(4-cyclopropyloxyphenyl)-1-(3,5-dimethylphenyl)ethanol
CID 114518706
3-(4-cyclopropyloxyphenyl)-N,3-dimethylbutan-1-amine
CID 114520483
1-(4-methylcyclohexyl)oxy-4-(2,4,4-trimethylpentan-2-yl)benzene
CID 21137300
1-(4-chloro-2-methylpentan-2-yl)-4-cyclopropyloxybenzene
CID 114520237
2-chloro-4-[4-[2-(4-cyclobutyloxyphenyl)propan-2-yl]phenoxy]pyridine
CID 175849398
4-(4-tert-butylphenoxy)-1-ethylpiperidine
CID 118546891
4-[4-(trifluoromethyl)phenoxy]cyclohexan-1-amine
CID 18460866

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene?
The IUPAC name of 1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene (CID 175031556) is 1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene.
What is the SMILES notation for 1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene?
The canonical SMILES for 1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene is CC(C)(c1ccc(OC2CC2)cc1)c1ccc(OC2CC2)cc1.
What is the InChIKey of 1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene?
The InChIKey is XADZCGCKYJWFAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24O2/c1-21(2,15-3-7-17(8-4-15)22-19-11-12-19)16-5-9-18(10-6-16)23-20-13-14-20/h3-10,19-20H,11-14H2,1-2H3.
What are the key properties of 1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene?
1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene has a molecular weight of 308.42 g/mol, XLogP of 5.09, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyloxy-4-[2-(4-cyclopropyloxyphenyl)propan-2-yl]benzene is sourced from PubChem (CID 175031556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).