[2-(3-chlorophenyl)-1-methylcyclopropyl]methanol

C11H13ClO — CID 139784418

IUPAC[2-(3-chlorophenyl)-1-methylcyclopropyl]methanol
SMILESCC1(CO)CC1c1cccc(Cl)c1
InChIInChI=1S/C11H13ClO/c1-11(7-13)6-10(11)8-3-2-4-9(12)5-8/h2-5,10,13H,6-7H2,1H3
InChIKeyUVYHKVQIDLFAKY-UHFFFAOYSA-N
MW196.68 g/mol
LogP2.83
Rot. Bonds2

About [2-(3-chlorophenyl)-1-methylcyclopropyl]methanol

[2-(3-chlorophenyl)-1-methylcyclopropyl]methanol (PubChem CID 139784418) has the molecular formula C11H13ClO and a molecular weight of 196.68 g/mol. Its IUPAC name is [2-(3-chlorophenyl)-1-methylcyclopropyl]methanol.

Molecular Properties

Compound Name[2-(3-chlorophenyl)-1-methylcyclopropyl]methanol
PubChem CID139784418
Molecular FormulaC11H13ClO
Molecular Weight196.68 g/mol
Exact Mass196.07
IUPAC Name[2-(3-chlorophenyl)-1-methylcyclopropyl]methanol
SMILESCC1(CO)CC1c1cccc(Cl)c1
InChIInChI=1S/C11H13ClO/c1-11(7-13)6-10(11)8-3-2-4-9(12)5-8/h2-5,10,13H,6-7H2,1H3
InChIKeyUVYHKVQIDLFAKY-UHFFFAOYSA-N
XLogP2.83
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.68
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[(1R,2S)-2-(4-chlorophenyl)-1-methylcyclopropyl]methanol
CID 67865939
2-(3-chlorophenyl)-1-propan-2-ylcyclopropan-1-amine
CID 84677435
2-(3-chlorophenyl)cyclopropane-1,1-dicarboxamide
CID 175097065
4-(3-chlorophenyl)-2-methylpyrrolidine-2-carboxylic acid
CID 117270243
trans-(1R,3R)-3-(3-chlorophenyl)-2,2-dimethylcyclopropane-1-carboxylic acid
CID 11481517
(3S,5R)-5-(3-chlorophenyl)-6-(4-chlorophenyl)-3-ethyl-3-methyloxan-2-one
CID 122537195
(3R,5R,6R)-5-(3-chlorophenyl)-6-(4-chlorophenyl)-3-methyl-3-(2-oxopropyl)oxan-2-one
CID 170225553
2-[5-(3-chlorophenyl)-1,6-diethyl-3-methyl-2-oxopiperidin-3-yl]acetic acid
CID 123206539
(4R)-4-(3-chlorophenyl)-3,3-diethylpyrrolidine
CID 125451105
N-[(2S,6R)-2,6-bis(3-chlorophenyl)-4-methyloxan-4-yl]propanamide
CID 110155144
1-[3-(3-chlorophenyl)-2,2-dimethylcyclopropyl]propan-1-one
CID 20778842
3-(3-chlorophenyl)-4,4-dimethylpiperidine-2,6-dione
CID 79429755

Frequently Asked Questions

What is the IUPAC name of [2-(3-chlorophenyl)-1-methylcyclopropyl]methanol?
The IUPAC name of [2-(3-chlorophenyl)-1-methylcyclopropyl]methanol (CID 139784418) is [2-(3-chlorophenyl)-1-methylcyclopropyl]methanol.
What is the SMILES notation for [2-(3-chlorophenyl)-1-methylcyclopropyl]methanol?
The canonical SMILES for [2-(3-chlorophenyl)-1-methylcyclopropyl]methanol is CC1(CO)CC1c1cccc(Cl)c1.
What is the InChIKey of [2-(3-chlorophenyl)-1-methylcyclopropyl]methanol?
The InChIKey is UVYHKVQIDLFAKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClO/c1-11(7-13)6-10(11)8-3-2-4-9(12)5-8/h2-5,10,13H,6-7H2,1H3.
What are the key properties of [2-(3-chlorophenyl)-1-methylcyclopropyl]methanol?
[2-(3-chlorophenyl)-1-methylcyclopropyl]methanol has a molecular weight of 196.68 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-chlorophenyl)-1-methylcyclopropyl]methanol is sourced from PubChem (CID 139784418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).