2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol

C15H18ClNO — CID 84639329

IUPAC2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol
SMILESCn1cc(CC2CCCC2O)c2cc(Cl)ccc21
InChIInChI=1S/C15H18ClNO/c1-17-9-11(7-10-3-2-4-15(10)18)13-8-12(16)5-6-14(13)17/h5-6,8-10,15,18H,2-4,7H2,1H3
InChIKeyDJULIUWDWWJPSX-UHFFFAOYSA-N
MW263.77 g/mol
LogP3.54
Rot. Bonds2

About 2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol

2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol (PubChem CID 84639329) has the molecular formula C15H18ClNO and a molecular weight of 263.77 g/mol. Its IUPAC name is 2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol
PubChem CID84639329
Molecular FormulaC15H18ClNO
Molecular Weight263.77 g/mol
Exact Mass263.11
IUPAC Name2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol
SMILESCn1cc(CC2CCCC2O)c2cc(Cl)ccc21
InChIInChI=1S/C15H18ClNO/c1-17-9-11(7-10-3-2-4-15(10)18)13-8-12(16)5-6-14(13)17/h5-6,8-10,15,18H,2-4,7H2,1H3
InChIKeyDJULIUWDWWJPSX-UHFFFAOYSA-N
XLogP3.54
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.77
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(7-fluoro-1-methylindol-3-yl)methyl]cyclopentan-1-ol
CID 84632821
2-[(5-methoxy-1-methylindol-3-yl)methyl]cyclopentan-1-amine
CID 84637267
5-chloro-3-cyclohexyl-1-methylindole
CID 135084055
3-amino-4-(5-chloro-1-methylindol-3-yl)but-1-en-2-ol;ethane
CID 153346453
5-chloro-1-methyl-3-(pyridin-3-yloxymethyl)indole
CID 117175188
1,5-dimethyl-3-(piperidin-3-ylmethyl)indole
CID 84630406
N-[(5-chloro-1-propan-2-ylindol-3-yl)methyl]cyclopentanamine
CID 117175445
2-(5-chloro-1-cyclopentylindol-3-yl)acetic acid
CID 83785093
2-(5-chloro-1-methylindol-3-yl)propanoic acid
CID 18175124
1-[(5-chloro-1-methylindol-3-yl)methyl]-N-[[4-(dimethylamino)phenyl]methyl]piperidine-4-carboxamide
CID 53117838
2-[(5-ethyl-1-methylindol-3-yl)methyl]cyclopentan-1-one
CID 84635769
2-[(1-methylindol-3-yl)methylamino]cycloheptan-1-ol
CID 107236127

Frequently Asked Questions

What is the IUPAC name of 2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol?
The IUPAC name of 2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol (CID 84639329) is 2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol is Cn1cc(CC2CCCC2O)c2cc(Cl)ccc21.
What is the InChIKey of 2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol?
The InChIKey is DJULIUWDWWJPSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClNO/c1-17-9-11(7-10-3-2-4-15(10)18)13-8-12(16)5-6-14(13)17/h5-6,8-10,15,18H,2-4,7H2,1H3.
What are the key properties of 2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol?
2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol has a molecular weight of 263.77 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chloro-1-methylindol-3-yl)methyl]cyclopentan-1-ol is sourced from PubChem (CID 84639329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).