1-(cyclopentyloxymethyl)-3-cyclopropylbenzene

C15H20O — CID 126674869

IUPAC1-(cyclopentyloxymethyl)-3-cyclopropylbenzene
SMILESc1cc(COC2CCCC2)cc(C2CC2)c1
InChIInChI=1S/C15H20O/c1-2-7-15(6-1)16-11-12-4-3-5-14(10-12)13-8-9-13/h3-5,10,13,15H,1-2,6-9,11H2
InChIKeyLWCNZVSCLZTXLQ-UHFFFAOYSA-N
MW216.32 g/mol
LogP4.02
Rot. Bonds4

About 1-(cyclopentyloxymethyl)-3-cyclopropylbenzene

1-(cyclopentyloxymethyl)-3-cyclopropylbenzene (PubChem CID 126674869) has the molecular formula C15H20O and a molecular weight of 216.32 g/mol. Its IUPAC name is 1-(cyclopentyloxymethyl)-3-cyclopropylbenzene.

Molecular Properties

Compound Name1-(cyclopentyloxymethyl)-3-cyclopropylbenzene
PubChem CID126674869
Molecular FormulaC15H20O
Molecular Weight216.32 g/mol
Exact Mass216.15
IUPAC Name1-(cyclopentyloxymethyl)-3-cyclopropylbenzene
SMILESc1cc(COC2CCCC2)cc(C2CC2)c1
InChIInChI=1S/C15H20O/c1-2-7-15(6-1)16-11-12-4-3-5-14(10-12)13-8-9-13/h3-5,10,13,15H,1-2,6-9,11H2
InChIKeyLWCNZVSCLZTXLQ-UHFFFAOYSA-N
XLogP4.02
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(4-phenylcyclohexyl)oxymethylbenzene
CID 11043723
3-cyclohexyloxy-N-[(3-cyclopropylphenyl)methyl]propan-1-amine
CID 79970546
2-[3-(cyclopentyloxymethyl)phenyl]acetaldehyde
CID 126676114
N-[(3-cyclopropylphenyl)methyl]cyclopentanamine
CID 79979605
azane;cyclopentyloxymethylbenzene
CID 69411306
[3-(cyclohexyloxymethyl)phenyl]boronic acid
CID 53211400
1-cyclopentyl-N-[(3-cyclopropylphenyl)methyl]methanamine
CID 79978912
N-[[3-(cyclohexyloxymethyl)phenyl]methyl]methanesulfonamide
CID 56787557
1-(cyclohexyloxymethyl)-3-nitrobenzene
CID 11264832
(3-cyclopropylphenyl)methanethiol
CID 79977406
(3-cyclohexylphenyl)methanethiol
CID 22000684
(3-cycloheptylphenyl)methanol
CID 84672634

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentyloxymethyl)-3-cyclopropylbenzene?
The IUPAC name of 1-(cyclopentyloxymethyl)-3-cyclopropylbenzene (CID 126674869) is 1-(cyclopentyloxymethyl)-3-cyclopropylbenzene.
What is the SMILES notation for 1-(cyclopentyloxymethyl)-3-cyclopropylbenzene?
The canonical SMILES for 1-(cyclopentyloxymethyl)-3-cyclopropylbenzene is c1cc(COC2CCCC2)cc(C2CC2)c1.
What is the InChIKey of 1-(cyclopentyloxymethyl)-3-cyclopropylbenzene?
The InChIKey is LWCNZVSCLZTXLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O/c1-2-7-15(6-1)16-11-12-4-3-5-14(10-12)13-8-9-13/h3-5,10,13,15H,1-2,6-9,11H2.
What are the key properties of 1-(cyclopentyloxymethyl)-3-cyclopropylbenzene?
1-(cyclopentyloxymethyl)-3-cyclopropylbenzene has a molecular weight of 216.32 g/mol, XLogP of 4.02, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentyloxymethyl)-3-cyclopropylbenzene is sourced from PubChem (CID 126674869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).