2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide

C17H23ClN2O2 — CID 111697345

IUPAC2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide
SMILESCCCC(CCO)CNC(=O)Cc1c[nH]c2ccc(Cl)cc12
InChIInChI=1S/C17H23ClN2O2/c1-2-3-12(6-7-21)10-20-17(22)8-13-11-19-16-5-4-14(18)9-15(13)16/h4-5,9,11-12,19,21H,2-3,6-8,10H2,1H3,(H,20,22)
InChIKeyFSVROOLVXAFECH-UHFFFAOYSA-N
MW322.84 g/mol
LogP3.28
Rot. Bonds8

About 2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide

2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide (PubChem CID 111697345) has the molecular formula C17H23ClN2O2 and a molecular weight of 322.84 g/mol. Its IUPAC name is 2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide.

Molecular Properties

Compound Name2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide
PubChem CID111697345
Molecular FormulaC17H23ClN2O2
Molecular Weight322.84 g/mol
Exact Mass322.14
IUPAC Name2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide
SMILESCCCC(CCO)CNC(=O)Cc1c[nH]c2ccc(Cl)cc12
InChIInChI=1S/C17H23ClN2O2/c1-2-3-12(6-7-21)10-20-17(22)8-13-11-19-16-5-4-14(18)9-15(13)16/h4-5,9,11-12,19,21H,2-3,6-8,10H2,1H3,(H,20,22)
InChIKeyFSVROOLVXAFECH-UHFFFAOYSA-N
XLogP3.28
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.84
LogP ≤ 53.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-chloro-1H-indol-3-yl)-N-[(4-chlorophenyl)methyl]acetamide
CID 113209503
2-(5-chloro-1H-indol-3-yl)-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide
CID 111441170
2,5-dichloro-N-[2-(2-hydroxyethyl)pentyl]benzamide
CID 103725481
N-(3-acetamidopropyl)-2-(5-chloro-1H-indol-3-yl)acetamide
CID 110630730
2-(5-chloro-1H-indol-3-yl)-N-[(4S,5S)-2,5-dimethyl-3-oxoheptan-4-yl]acetamide
CID 58842077
2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide
CID 110621183
2-(5-chloro-1H-indol-3-yl)-N-methoxyacetamide
CID 110611810
2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide
CID 110625376
4-chloro-N-[2-(2-hydroxyethyl)pentyl]-2-methoxybenzamide
CID 103722901
1-(5-chloro-1H-indol-3-yl)-3-methylbutan-2-one
CID 166554148
N-[2-(5-chloro-1H-indol-3-yl)ethyl]-2-ethylhexanamide
CID 17271856
2-(5-chloro-1H-indol-3-yl)-N-[2-(3-chlorophenyl)ethyl]acetamide
CID 113209520

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide?
The IUPAC name of 2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide (CID 111697345) is 2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide.
What is the SMILES notation for 2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide?
The canonical SMILES for 2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide is CCCC(CCO)CNC(=O)Cc1c[nH]c2ccc(Cl)cc12.
What is the InChIKey of 2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide?
The InChIKey is FSVROOLVXAFECH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23ClN2O2/c1-2-3-12(6-7-21)10-20-17(22)8-13-11-19-16-5-4-14(18)9-15(13)16/h4-5,9,11-12,19,21H,2-3,6-8,10H2,1H3,(H,20,22).
What are the key properties of 2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide?
2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide has a molecular weight of 322.84 g/mol, XLogP of 3.28, 8 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide is sourced from PubChem (CID 111697345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).