7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine

C23H25ClN4 — CID 142594371

IUPAC7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine
SMILESCC(C)c1c(-c2cc(Cl)cc3nccn23)[nH]c2ccc(C3CCNCC3)cc12
InChIInChI=1S/C23H25ClN4/c1-14(2)22-18-11-16(15-5-7-25-8-6-15)3-4-19(18)27-23(22)20-12-17(24)13-21-26-9-10-28(20)21/h3-4,9-15,25,27H,5-8H2,1-2H3
InChIKeyBQBZAFGGUPWRGV-UHFFFAOYSA-N
MW392.93 g/mol
LogP5.73
Rot. Bonds3

About 7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine

7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine (PubChem CID 142594371) has the molecular formula C23H25ClN4 and a molecular weight of 392.93 g/mol. Its IUPAC name is 7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine
PubChem CID142594371
Molecular FormulaC23H25ClN4
Molecular Weight392.93 g/mol
Exact Mass392.18
IUPAC Name7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine
SMILESCC(C)c1c(-c2cc(Cl)cc3nccn23)[nH]c2ccc(C3CCNCC3)cc12
InChIInChI=1S/C23H25ClN4/c1-14(2)22-18-11-16(15-5-7-25-8-6-15)3-4-19(18)27-23(22)20-12-17(24)13-21-26-9-10-28(20)21/h3-4,9-15,25,27H,5-8H2,1-2H3
InChIKeyBQBZAFGGUPWRGV-UHFFFAOYSA-N
XLogP5.73
TPSA45.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.93
LogP ≤ 55.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-methyl-7-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine
CID 142594108
2-(5-chloro-2-fluoro-4-pyridinyl)-5-piperidin-4-yl-3-propan-2-yl-1H-indole
CID 134330056
6-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 142594847
2-(3-fluoro-2-methyl-4-pyridinyl)-5-piperidin-4-yl-3-propan-2-yl-1H-indole
CID 134329624
2,5-dimethyl-6-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)pyridazin-3-one
CID 137464299
7-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-imidazo[4,5-b]pyridine
CID 142594142
3-methyl-7-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[4,5-b]pyridine
CID 142593803
4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)pyrrolo[2,1-f][1,2,4]triazine
CID 142594728
4-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
CID 142594151
5-piperidin-4-yl-3-propan-2-yl-2-(2,3,6-trimethyl-4-pyridinyl)-1H-indole
CID 134330320
5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-2H-benzotriazole
CID 142593838
5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)-1H-pyrazolo[3,4-c]pyridine
CID 142594027

Frequently Asked Questions

What is the IUPAC name of 7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine?
The IUPAC name of 7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine (CID 142594371) is 7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine?
The canonical SMILES for 7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine is CC(C)c1c(-c2cc(Cl)cc3nccn23)[nH]c2ccc(C3CCNCC3)cc12.
What is the InChIKey of 7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine?
The InChIKey is BQBZAFGGUPWRGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25ClN4/c1-14(2)22-18-11-16(15-5-7-25-8-6-15)3-4-19(18)27-23(22)20-12-17(24)13-21-26-9-10-28(20)21/h3-4,9-15,25,27H,5-8H2,1-2H3.
What are the key properties of 7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine?
7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine has a molecular weight of 392.93 g/mol, XLogP of 5.73, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-5-(5-piperidin-4-yl-3-propan-2-yl-1H-indol-2-yl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 142594371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).