4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide

C24H30N4O — CID 112825895

IUPAC4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide
SMILESO=C(Nc1ccccc1N1CCc2ccccc21)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C24H30N4O/c29-24(27-17-15-26(16-18-27)20-8-2-3-9-20)25-21-10-4-6-12-23(21)28-14-13-19-7-1-5-11-22(19)28/h1,4-7,10-12,20H,2-3,8-9,13-18H2,(H,25,29)
InChIKeyHIBSZPRAPXJCKC-UHFFFAOYSA-N
MW390.53 g/mol
LogP4.47
Rot. Bonds3

About 4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide

4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide (PubChem CID 112825895) has the molecular formula C24H30N4O and a molecular weight of 390.53 g/mol. Its IUPAC name is 4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide.

Molecular Properties

Compound Name4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide
PubChem CID112825895
Molecular FormulaC24H30N4O
Molecular Weight390.53 g/mol
Exact Mass390.24
IUPAC Name4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide
SMILESO=C(Nc1ccccc1N1CCc2ccccc21)N1CCN(C2CCCC2)CC1
InChIInChI=1S/C24H30N4O/c29-24(27-17-15-26(16-18-27)20-8-2-3-9-20)25-21-10-4-6-12-23(21)28-14-13-19-7-1-5-11-22(19)28/h1,4-7,10-12,20H,2-3,8-9,13-18H2,(H,25,29)
InChIKeyHIBSZPRAPXJCKC-UHFFFAOYSA-N
XLogP4.47
TPSA38.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.53
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide?
The IUPAC name of 4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide (CID 112825895) is 4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide.
What is the SMILES notation for 4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide?
The canonical SMILES for 4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide is O=C(Nc1ccccc1N1CCc2ccccc21)N1CCN(C2CCCC2)CC1.
What is the InChIKey of 4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide?
The InChIKey is HIBSZPRAPXJCKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O/c29-24(27-17-15-26(16-18-27)20-8-2-3-9-20)25-21-10-4-6-12-23(21)28-14-13-19-7-1-5-11-22(19)28/h1,4-7,10-12,20H,2-3,8-9,13-18H2,(H,25,29).
What are the key properties of 4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide?
4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide has a molecular weight of 390.53 g/mol, XLogP of 4.47, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-N-[2-(2,3-dihydroindol-1-yl)phenyl]piperazine-1-carboxamide is sourced from PubChem (CID 112825895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).