2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide

C22H23N3O2 — CID 32534114

IUPAC2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide
SMILESCc1[nH]c2ccccc2c1CC(=O)Nc1cccc(N2CCCCC2=O)c1
InChIInChI=1S/C22H23N3O2/c1-15-19(18-9-2-3-10-20(18)23-15)14-21(26)24-16-7-6-8-17(13-16)25-12-5-4-11-22(25)27/h2-3,6-10,13,23H,4-5,11-12,14H2,1H3,(H,24,26)
InChIKeyLTESJEDEIPQIOO-UHFFFAOYSA-N
MW361.45 g/mol
LogP4.17
Rot. Bonds4

About 2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide

2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide (PubChem CID 32534114) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is 2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide
PubChem CID32534114
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC Name2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide
SMILESCc1[nH]c2ccccc2c1CC(=O)Nc1cccc(N2CCCCC2=O)c1
InChIInChI=1S/C22H23N3O2/c1-15-19(18-9-2-3-10-20(18)23-15)14-21(26)24-16-7-6-8-17(13-16)25-12-5-4-11-22(25)27/h2-3,6-10,13,23H,4-5,11-12,14H2,1H3,(H,24,26)
InChIKeyLTESJEDEIPQIOO-UHFFFAOYSA-N
XLogP4.17
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 54.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

2-(2-methyl-1H-indol-3-yl)-N-[3-(2-methyl-5-oxopyrrolidin-1-yl)phenyl]acetamide
CID 131933787
2-(4-bromophenyl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide
CID 46425011
N-(3-chlorophenyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 31856117
3-[2-oxo-2-[3-(2-oxopiperidin-1-yl)anilino]ethyl]benzoic acid
CID 120549405
N-[(4-methylphenyl)methyl]-N'-[3-(2-oxopiperidin-1-yl)phenyl]oxamide
CID 18584462
tert-butyl N-[4-[2-oxo-2-[3-(2-oxopyrrolidin-1-yl)anilino]ethyl]phenyl]carbamate
CID 46556759
2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide
CID 46404795
N-benzyl-N'-[3-(2-oxopiperidin-1-yl)phenyl]oxamide
CID 18584460
4-(methylamino)-N-[3-(2-oxopyrrolidin-1-yl)phenyl]butanamide;hydrochloride
CID 119692821
2-(4-methoxyphenoxy)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide
CID 7687689
2-(2-nitrophenyl)-N-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 26458961
2-methyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]propanamide
CID 7686856

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide?
The IUPAC name of 2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide (CID 32534114) is 2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide?
The canonical SMILES for 2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide is Cc1[nH]c2ccccc2c1CC(=O)Nc1cccc(N2CCCCC2=O)c1.
What is the InChIKey of 2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide?
The InChIKey is LTESJEDEIPQIOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-15-19(18-9-2-3-10-20(18)23-15)14-21(26)24-16-7-6-8-17(13-16)25-12-5-4-11-22(25)27/h2-3,6-10,13,23H,4-5,11-12,14H2,1H3,(H,24,26).
What are the key properties of 2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide?
2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide has a molecular weight of 361.45 g/mol, XLogP of 4.17, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-1H-indol-3-yl)-N-[3-(2-oxopiperidin-1-yl)phenyl]acetamide is sourced from PubChem (CID 32534114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).