1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide

C23H32N4O3 — CID 69283945

IUPAC1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide
SMILESCC(C)N1CCC(Oc2ccc3[nH]c(C(=O)N4CCC(C(N)=O)CC4)cc3c2)CC1
InChIInChI=1S/C23H32N4O3/c1-15(2)26-11-7-18(8-12-26)30-19-3-4-20-17(13-19)14-21(25-20)23(29)27-9-5-16(6-10-27)22(24)28/h3-4,13-16,18,25H,5-12H2,1-2H3,(H2,24,28)
InChIKeyIGRDDZUPEFSPLT-UHFFFAOYSA-N
MW412.53 g/mol
LogP2.76
Rot. Bonds5

About 1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide

1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide (PubChem CID 69283945) has the molecular formula C23H32N4O3 and a molecular weight of 412.53 g/mol. Its IUPAC name is 1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide
PubChem CID69283945
Molecular FormulaC23H32N4O3
Molecular Weight412.53 g/mol
Exact Mass412.25
IUPAC Name1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide
SMILESCC(C)N1CCC(Oc2ccc3[nH]c(C(=O)N4CCC(C(N)=O)CC4)cc3c2)CC1
InChIInChI=1S/C23H32N4O3/c1-15(2)26-11-7-18(8-12-26)30-19-3-4-20-17(13-19)14-21(25-20)23(29)27-9-5-16(6-10-27)22(24)28/h3-4,13-16,18,25H,5-12H2,1-2H3,(H2,24,28)
InChIKeyIGRDDZUPEFSPLT-UHFFFAOYSA-N
XLogP2.76
TPSA91.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.53
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide with MolForge

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Related Compounds

(4-propan-2-ylpiperazin-1-yl)-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone
CID 69284738
(4-propan-2-ylpiperazin-1-yl)-[5-(1-propan-2-ylpyrrolidin-3-yl)oxy-1H-indol-2-yl]methanone
CID 69283170
[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]-(3-pyridin-2-ylpyrrolidin-1-yl)methanone
CID 69283299
1-(5-methyl-1H-indole-2-carbonyl)piperidine-4-carboxamide
CID 7326182
[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]-[2-(trifluoromethyl)pyrrolidin-1-yl]methanone
CID 69282977
azepan-1-yl-[6-(1-propan-2-ylpyrrolidin-3-yl)oxy-1H-indol-2-yl]methanone
CID 69282604
(4-fluorophenyl)sulfonyl-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indol-2-yl]methanone
CID 87759520
methyl 5-(1-propan-2-ylpyrrolidin-3-yl)oxy-1H-indole-2-carboxylate
CID 150365162
[2-(4-methoxypiperidine-1-carbonyl)-1H-indol-5-yl]-(4-propan-2-ylpiperazin-1-yl)methanone
CID 68683427
(4-propan-2-ylpiperazin-1-yl)-[6-(1-propan-2-ylpiperidin-4-yl)oxynaphthalen-2-yl]methanone
CID 69070920
N-(furan-2-ylmethyl)-5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carboxamide
CID 90889256
[2-(4-hydroxypiperidine-1-carbonyl)-1H-indol-5-yl]-(4-propan-2-ylpiperazin-1-yl)methanone
CID 68680973

Frequently Asked Questions

What is the IUPAC name of 1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide?
The IUPAC name of 1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide (CID 69283945) is 1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide is CC(C)N1CCC(Oc2ccc3[nH]c(C(=O)N4CCC(C(N)=O)CC4)cc3c2)CC1.
What is the InChIKey of 1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide?
The InChIKey is IGRDDZUPEFSPLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N4O3/c1-15(2)26-11-7-18(8-12-26)30-19-3-4-20-17(13-19)14-21(25-20)23(29)27-9-5-16(6-10-27)22(24)28/h3-4,13-16,18,25H,5-12H2,1-2H3,(H2,24,28).
What are the key properties of 1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide?
1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide has a molecular weight of 412.53 g/mol, XLogP of 2.76, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carbonyl]piperidine-4-carboxamide is sourced from PubChem (CID 69283945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).