(5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol

C12H15ClO2 — CID 65420387

IUPAC(5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol
SMILESCOc1ccc(Cl)cc1C(O)C1CC1C
InChIInChI=1S/C12H15ClO2/c1-7-5-9(7)12(14)10-6-8(13)3-4-11(10)15-2/h3-4,6-7,9,12,14H,5H2,1-2H3
InChIKeyGSOIYEDTNIMWSI-UHFFFAOYSA-N
MW226.70 g/mol
LogP3.04
Rot. Bonds3

About (5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol

(5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol (PubChem CID 65420387) has the molecular formula C12H15ClO2 and a molecular weight of 226.70 g/mol. Its IUPAC name is (5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol.

Molecular Properties

Compound Name(5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol
PubChem CID65420387
Molecular FormulaC12H15ClO2
Molecular Weight226.70 g/mol
Exact Mass226.08
IUPAC Name(5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol
SMILESCOc1ccc(Cl)cc1C(O)C1CC1C
InChIInChI=1S/C12H15ClO2/c1-7-5-9(7)12(14)10-6-8(13)3-4-11(10)15-2/h3-4,6-7,9,12,14H,5H2,1-2H3
InChIKeyGSOIYEDTNIMWSI-UHFFFAOYSA-N
XLogP3.04
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.70
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-bicyclo[2.2.1]heptanyl-(5-chloro-2-methoxyphenyl)methanol
CID 113383462
(5-chloro-2-methoxyphenyl)-cyclooctylmethanol
CID 80603904
(5-chloro-2-methoxyphenyl)-(5,6-dimethyl-1,4-dithian-2-yl)methanol
CID 103345211
(4-methoxy-3-pyridinyl)-(2-methylcyclopropyl)methanol
CID 130565651
2-[bromo-(2-methylcyclopentyl)methyl]-4-chloro-1-methoxybenzene
CID 107182621
(1S,2R)-2-amino-2-(5-chloro-2-methoxyphenyl)-1-cyclopropylethanol
CID 171265620
(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methanol
CID 107181861
(2-chlorophenyl)-(2-methylcyclopropyl)methanol
CID 65421692
(1S,2R)-1-amino-1-(5-chloro-2-methoxyphenyl)propan-2-ol
CID 130749346
2-bromo-1-(5-chloro-2-methoxyphenyl)propan-1-ol
CID 116863294
1-(5-chloro-2-methoxyphenyl)-2,3-dimethylbutan-1-ol
CID 104546198
1-(5-chloro-2-methoxyphenyl)-2-(1,3-dioxolan-2-yl)ethanol
CID 103547438

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol?
The IUPAC name of (5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol (CID 65420387) is (5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol.
What is the SMILES notation for (5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol?
The canonical SMILES for (5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol is COc1ccc(Cl)cc1C(O)C1CC1C.
What is the InChIKey of (5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol?
The InChIKey is GSOIYEDTNIMWSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClO2/c1-7-5-9(7)12(14)10-6-8(13)3-4-11(10)15-2/h3-4,6-7,9,12,14H,5H2,1-2H3.
What are the key properties of (5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol?
(5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol has a molecular weight of 226.70 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol is sourced from PubChem (CID 65420387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).