6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one

C24H21ClN4O2 — CID 177382697

IUPAC6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one
SMILESO=C1Cc2ccc(C(=O)N3CCN(c4ccc(-c5cccc(Cl)c5)cn4)CC3)cc2N1
InChIInChI=1S/C24H21ClN4O2/c25-20-3-1-2-16(12-20)19-6-7-22(26-15-19)28-8-10-29(11-9-28)24(31)18-5-4-17-14-23(30)27-21(17)13-18/h1-7,12-13,15H,8-11,14H2,(H,27,30)
InChIKeyJKBOABOLUIZKGD-UHFFFAOYSA-N
MW432.91 g/mol
LogP3.86
Rot. Bonds3

About 6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one

6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one (PubChem CID 177382697) has the molecular formula C24H21ClN4O2 and a molecular weight of 432.91 g/mol. Its IUPAC name is 6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one
PubChem CID177382697
Molecular FormulaC24H21ClN4O2
Molecular Weight432.91 g/mol
Exact Mass432.14
IUPAC Name6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one
SMILESO=C1Cc2ccc(C(=O)N3CCN(c4ccc(-c5cccc(Cl)c5)cn4)CC3)cc2N1
InChIInChI=1S/C24H21ClN4O2/c25-20-3-1-2-16(12-20)19-6-7-22(26-15-19)28-8-10-29(11-9-28)24(31)18-5-4-17-14-23(30)27-21(17)13-18/h1-7,12-13,15H,8-11,14H2,(H,27,30)
InChIKeyJKBOABOLUIZKGD-UHFFFAOYSA-N
XLogP3.86
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.91
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[4-(6-phenylpyrimidin-4-yl)piperazine-1-carbonyl]-1,3-dihydroindol-2-one
CID 108809049
4-(2-oxo-1,3-dihydroindole-6-carbonyl)piperazine-2,6-dione
CID 102712523
5-(4-quinolin-2-ylpiperazine-1-carbonyl)-1,3-dihydroindol-2-one
CID 108809070
4-(5-phenyl-2-pyridinyl)piperazine-1-carboxylic acid
CID 68644218
6-[4-(3-chlorobenzoyl)piperazin-1-yl]-3,4-dihydro-1H-quinolin-2-one
CID 13236324
6-(4-ethyl-4-methylpiperidine-1-carbonyl)-1,3-dihydroindol-2-one
CID 102712356
6-[4-(aminomethyl)piperidine-1-carbonyl]-1,3-dihydroindol-2-one
CID 102711454
5-[4-(5-chloro-2-pyridinyl)piperazine-1-carbonyl]-1H-pyridin-2-one
CID 56820279
[2-(azepan-1-yl)-4-pyridinyl]-[4-(3-chlorophenyl)piperazin-1-yl]methanone
CID 109174449
2-[5-(3-chlorophenyl)-2-pyridinyl]-1,5,5-trimethylpyrazolidin-3-one
CID 70936653
2-oxo-1,3-dihydroindole-6-carbonyl chloride
CID 141361971
6-(4-acetylpiperazin-1-yl)-N-(3-chlorophenyl)pyridine-3-carboxamide
CID 109155130

Frequently Asked Questions

What is the IUPAC name of 6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one?
The IUPAC name of 6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one (CID 177382697) is 6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one.
What is the SMILES notation for 6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one?
The canonical SMILES for 6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one is O=C1Cc2ccc(C(=O)N3CCN(c4ccc(-c5cccc(Cl)c5)cn4)CC3)cc2N1.
What is the InChIKey of 6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one?
The InChIKey is JKBOABOLUIZKGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21ClN4O2/c25-20-3-1-2-16(12-20)19-6-7-22(26-15-19)28-8-10-29(11-9-28)24(31)18-5-4-17-14-23(30)27-21(17)13-18/h1-7,12-13,15H,8-11,14H2,(H,27,30).
What are the key properties of 6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one?
6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one has a molecular weight of 432.91 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[5-(3-chlorophenyl)-2-pyridinyl]piperazine-1-carbonyl]-1,3-dihydroindol-2-one is sourced from PubChem (CID 177382697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).