N-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide

C21H22ClN3O — CID 17498519

IUPACN-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(c2c[nH]c3ccccc23)CC1)Nc1ccccc1Cl
InChIInChI=1S/C21H22ClN3O/c22-18-6-2-4-8-20(18)24-21(26)14-25-11-9-15(10-12-25)17-13-23-19-7-3-1-5-16(17)19/h1-8,13,15,23H,9-12,14H2,(H,24,26)
InChIKeyFVWOFYKPQXICQX-UHFFFAOYSA-N
MW367.88 g/mol
LogP4.64
Rot. Bonds4

About N-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide

N-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide (PubChem CID 17498519) has the molecular formula C21H22ClN3O and a molecular weight of 367.88 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide
PubChem CID17498519
Molecular FormulaC21H22ClN3O
Molecular Weight367.88 g/mol
Exact Mass367.15
IUPAC NameN-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(c2c[nH]c3ccccc23)CC1)Nc1ccccc1Cl
InChIInChI=1S/C21H22ClN3O/c22-18-6-2-4-8-20(18)24-21(26)14-25-11-9-15(10-12-25)17-13-23-19-7-3-1-5-16(17)19/h1-8,13,15,23H,9-12,14H2,(H,24,26)
InChIKeyFVWOFYKPQXICQX-UHFFFAOYSA-N
XLogP4.64
TPSA48.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.88
LogP ≤ 54.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(1H-indol-3-yl)piperidin-1-yl]-N-(4-piperidin-1-ylphenyl)acetamide
CID 55498493
3-chloro-2-[[4-(1H-indol-3-yl)piperidin-1-yl]methyl]benzoic acid
CID 136550117
N-(2-chlorophenyl)-2-pyrrolidin-1-ylacetamide;hydrochloride
CID 24832355
2-(azepan-1-yl)-N-(2-chlorophenyl)acetamide
CID 2070988
N-(2-acetylphenyl)-2-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)piperidin-1-yl]acetamide
CID 167880702
N-(2-chlorophenyl)-2-(3,9-diazabicyclo[4.2.1]nonan-3-yl)acetamide
CID 81491367
N-(2-chlorophenyl)-2-(4-methylpiperazin-1-yl)acetamide
CID 22197633
2-[4-(1-aminoethyl)piperidin-1-yl]-N-(2-chlorophenyl)acetamide;hydrochloride
CID 119920864
N-[2-[4-(1H-indol-3-yl)piperidin-1-yl]ethyl]benzamide
CID 54526531
N-(2-chlorophenyl)-2-[4-(2-chlorophenyl)piperazin-1-yl]acetamide
CID 2608315
N-(2-chlorophenyl)-2-(4-prop-2-ynylpiperazin-1-yl)acetamide
CID 47109715
2-[4-[2-(2-chloroanilino)-2-oxoethyl]piperazin-1-yl]-N-(2-methylphenyl)acetamide
CID 29161450

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide?
The IUPAC name of N-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide (CID 17498519) is N-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide is O=C(CN1CCC(c2c[nH]c3ccccc23)CC1)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide?
The InChIKey is FVWOFYKPQXICQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22ClN3O/c22-18-6-2-4-8-20(18)24-21(26)14-25-11-9-15(10-12-25)17-13-23-19-7-3-1-5-16(17)19/h1-8,13,15,23H,9-12,14H2,(H,24,26).
What are the key properties of N-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide?
N-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide has a molecular weight of 367.88 g/mol, XLogP of 4.64, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-[4-(1H-indol-3-yl)piperidin-1-yl]acetamide is sourced from PubChem (CID 17498519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).