1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol

C14H19ClO2 — CID 65154299

IUPAC1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol
SMILESCOc1ccc(Cl)cc1CC1(O)CCCC1C
InChIInChI=1S/C14H19ClO2/c1-10-4-3-7-14(10,16)9-11-8-12(15)5-6-13(11)17-2/h5-6,8,10,16H,3-4,7,9H2,1-2H3
InChIKeyZDRWQSHMWVIZDK-UHFFFAOYSA-N
MW254.76 g/mol
LogP3.44
Rot. Bonds3

About 1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol

1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol (PubChem CID 65154299) has the molecular formula C14H19ClO2 and a molecular weight of 254.76 g/mol. Its IUPAC name is 1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol.

Molecular Properties

Compound Name1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol
PubChem CID65154299
Molecular FormulaC14H19ClO2
Molecular Weight254.76 g/mol
Exact Mass254.11
IUPAC Name1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol
SMILESCOc1ccc(Cl)cc1CC1(O)CCCC1C
InChIInChI=1S/C14H19ClO2/c1-10-4-3-7-14(10,16)9-11-8-12(15)5-6-13(11)17-2/h5-6,8,10,16H,3-4,7,9H2,1-2H3
InChIKeyZDRWQSHMWVIZDK-UHFFFAOYSA-N
XLogP3.44
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.76
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(5-chloro-2-methoxyphenyl)methyl]-2,4-dimethylcyclohexan-1-ol
CID 65153588
2-tert-butyl-1-[(5-chloro-2-methoxyphenyl)methyl]cyclohexan-1-ol
CID 65147543
1-[(2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol
CID 65050430
4-[(5-chloro-2-methoxyphenyl)methyl]-3-ethylpiperidin-4-ol
CID 114510368
1-[(5-chloro-2-methoxyphenyl)methyl]-3-methoxycyclobutan-1-ol
CID 106823676
4-chloro-2-[[1-(chloromethyl)cyclopropyl]methyl]-1-methoxybenzene
CID 66034885
4-[(5-chloro-2-methoxyphenyl)methyl]-1-methylpiperidin-4-ol
CID 65146901
N-[[1-[(5-chloro-2-methoxyphenyl)methyl]cyclopropyl]methyl]propan-2-amine
CID 66025564
1-[(5-chloro-2-fluorophenyl)methyl]-2,4-dimethylcyclohexan-1-ol
CID 103047644
N-[[1-[(5-chloro-2-methoxyphenyl)methyl]cyclopropyl]methyl]cyclopropanamine
CID 66023806
N-[[1-[(5-chloro-2-methoxyphenyl)methyl]cyclobutyl]methyl]propan-1-amine
CID 65194491
3-[(5-chloro-2-methoxyphenyl)methyl]-1-methylpyrrolidin-3-ol
CID 65147101

Frequently Asked Questions

What is the IUPAC name of 1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol?
The IUPAC name of 1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol (CID 65154299) is 1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol.
What is the SMILES notation for 1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol?
The canonical SMILES for 1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol is COc1ccc(Cl)cc1CC1(O)CCCC1C.
What is the InChIKey of 1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol?
The InChIKey is ZDRWQSHMWVIZDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClO2/c1-10-4-3-7-14(10,16)9-11-8-12(15)5-6-13(11)17-2/h5-6,8,10,16H,3-4,7,9H2,1-2H3.
What are the key properties of 1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol?
1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol has a molecular weight of 254.76 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-chloro-2-methoxyphenyl)methyl]-2-methylcyclopentan-1-ol is sourced from PubChem (CID 65154299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).