1-(2-chloro-6-cyclopropyloxyphenyl)ethanone

C11H11ClO2 — CID 144572447

IUPAC1-(2-chloro-6-cyclopropyloxyphenyl)ethanone
SMILESCC(=O)c1c(Cl)cccc1OC1CC1
InChIInChI=1S/C11H11ClO2/c1-7(13)11-9(12)3-2-4-10(11)14-8-5-6-8/h2-4,8H,5-6H2,1H3
InChIKeyFWFUDBGAKAUBDY-UHFFFAOYSA-N
MW210.66 g/mol
LogP3.08
Rot. Bonds3

About 1-(2-chloro-6-cyclopropyloxyphenyl)ethanone

1-(2-chloro-6-cyclopropyloxyphenyl)ethanone (PubChem CID 144572447) has the molecular formula C11H11ClO2 and a molecular weight of 210.66 g/mol. Its IUPAC name is 1-(2-chloro-6-cyclopropyloxyphenyl)ethanone.

Molecular Properties

Compound Name1-(2-chloro-6-cyclopropyloxyphenyl)ethanone
PubChem CID144572447
Molecular FormulaC11H11ClO2
Molecular Weight210.66 g/mol
Exact Mass210.04
IUPAC Name1-(2-chloro-6-cyclopropyloxyphenyl)ethanone
SMILESCC(=O)c1c(Cl)cccc1OC1CC1
InChIInChI=1S/C11H11ClO2/c1-7(13)11-9(12)3-2-4-10(11)14-8-5-6-8/h2-4,8H,5-6H2,1H3
InChIKeyFWFUDBGAKAUBDY-UHFFFAOYSA-N
XLogP3.08
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.66
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chloro-6-methoxyphenyl)ethanone
CID 71464357
2-chloro-6-piperidin-4-yloxybenzamide
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CID 62496519
1,2-dichloro-3-cyclobutyloxybenzene
CID 130038402
(2-acetyl-3-chlorophenyl) N,N-diethylcarbamate
CID 10945491
2-chloro-N'-hydroxy-6-(oxan-4-yloxy)benzenecarboximidamide
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carbonic acid;4-(2-chlorophenoxy)piperidine
CID 23722971
1-[2-(4-aminocyclohexyl)oxyphenyl]ethanone
CID 117051794
1-[1-(3-cyclopropyloxy-2-hydroxyphenyl)-4-ethenyl-2,5-dimethylpyrrol-3-yl]ethanone
CID 166126558
(4-methylcyclohexyl) 2-amino-6-chlorobenzoate
CID 63662016
2-chloro-6-(3,4-dimethylcyclohexyl)oxybenzenecarboximidamide
CID 64744981
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CID 82928444

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-6-cyclopropyloxyphenyl)ethanone?
The IUPAC name of 1-(2-chloro-6-cyclopropyloxyphenyl)ethanone (CID 144572447) is 1-(2-chloro-6-cyclopropyloxyphenyl)ethanone.
What is the SMILES notation for 1-(2-chloro-6-cyclopropyloxyphenyl)ethanone?
The canonical SMILES for 1-(2-chloro-6-cyclopropyloxyphenyl)ethanone is CC(=O)c1c(Cl)cccc1OC1CC1.
What is the InChIKey of 1-(2-chloro-6-cyclopropyloxyphenyl)ethanone?
The InChIKey is FWFUDBGAKAUBDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClO2/c1-7(13)11-9(12)3-2-4-10(11)14-8-5-6-8/h2-4,8H,5-6H2,1H3.
What are the key properties of 1-(2-chloro-6-cyclopropyloxyphenyl)ethanone?
1-(2-chloro-6-cyclopropyloxyphenyl)ethanone has a molecular weight of 210.66 g/mol, XLogP of 3.08, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-6-cyclopropyloxyphenyl)ethanone is sourced from PubChem (CID 144572447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).