4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one

C23H26N4O — CID 142594151

IUPAC4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
SMILESCC(C)c1c(-c2ccnc3c2CC(=O)N3)[nH]c2ccc(C3CCNCC3)cc12
InChIInChI=1S/C23H26N4O/c1-13(2)21-18-11-15(14-5-8-24-9-6-14)3-4-19(18)26-22(21)16-7-10-25-23-17(16)12-20(28)27-23/h3-4,7,10-11,13-14,24,26H,5-6,8-9,12H2,1-2H3,(H,25,27,28)
InChIKeyACMMDJCIOANXLK-UHFFFAOYSA-N
MW374.49 g/mol
LogP4.31
Rot. Bonds3

About 4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one

4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one (PubChem CID 142594151) has the molecular formula C23H26N4O and a molecular weight of 374.49 g/mol. Its IUPAC name is 4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one.

Molecular Properties

Compound Name4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
PubChem CID142594151
Molecular FormulaC23H26N4O
Molecular Weight374.49 g/mol
Exact Mass374.21
IUPAC Name4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
SMILESCC(C)c1c(-c2ccnc3c2CC(=O)N3)[nH]c2ccc(C3CCNCC3)cc12
InChIInChI=1S/C23H26N4O/c1-13(2)21-18-11-15(14-5-8-24-9-6-14)3-4-19(18)26-22(21)16-7-10-25-23-17(16)12-20(28)27-23/h3-4,7,10-11,13-14,24,26H,5-6,8-9,12H2,1-2H3,(H,25,27,28)
InChIKeyACMMDJCIOANXLK-UHFFFAOYSA-N
XLogP4.31
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 54.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one with MolForge

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Launch Full Analysis

Related Compounds

2-(3-fluoro-2-methyl-4-pyridinyl)-5-piperidin-4-yl-3-propan-2-yl-1H-indole
CID 134329624
7-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-imidazo[4,5-b]pyridine
CID 142594142
4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridin-3-ol
CID 142594614
3-methyl-7-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[4,5-b]pyridine
CID 142593803
3-methyl-4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrrolo[2,3-b]pyridine
CID 142593745
5-piperidin-4-yl-3-propan-2-yl-2-(2,3,6-trimethyl-4-pyridinyl)-1H-indole
CID 134330320
4-[5-(4-piperidin-4-yloxycyclohexyl)-3-propan-2-yl-1H-indol-2-yl]-1H-pyrazolo[3,4-b]pyridine
CID 151530371
2-(5-chloro-2-fluoro-4-pyridinyl)-5-piperidin-4-yl-3-propan-2-yl-1H-indole
CID 134330056
5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine
CID 142594027
5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-2H-benzotriazole
CID 142593838
2,5-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)pyridazin-3-one
CID 137464299
5-methyl-7-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine
CID 142594108

Frequently Asked Questions

What is the IUPAC name of 4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one?
The IUPAC name of 4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one (CID 142594151) is 4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one.
What is the SMILES notation for 4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one?
The canonical SMILES for 4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one is CC(C)c1c(-c2ccnc3c2CC(=O)N3)[nH]c2ccc(C3CCNCC3)cc12.
What is the InChIKey of 4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one?
The InChIKey is ACMMDJCIOANXLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O/c1-13(2)21-18-11-15(14-5-8-24-9-6-14)3-4-19(18)26-22(21)16-7-10-25-23-17(16)12-20(28)27-23/h3-4,7,10-11,13-14,24,26H,5-6,8-9,12H2,1-2H3,(H,25,27,28).
What are the key properties of 4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one?
4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one has a molecular weight of 374.49 g/mol, XLogP of 4.31, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one is sourced from PubChem (CID 142594151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).