5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide

C20H23ClN4O3 — CID 24736716

IUPAC5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide
SMILESO=C(NCc1ccco1)N1CCC(NC(=O)N2CCc3cc(Cl)ccc32)CC1
InChIInChI=1S/C20H23ClN4O3/c21-15-3-4-18-14(12-15)5-10-25(18)20(27)23-16-6-8-24(9-7-16)19(26)22-13-17-2-1-11-28-17/h1-4,11-12,16H,5-10,13H2,(H,22,26)(H,23,27)
InChIKeyQYSVDUABNHMJHP-UHFFFAOYSA-N
MW402.88 g/mol
LogP3.38
Rot. Bonds3

About 5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide

5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide (PubChem CID 24736716) has the molecular formula C20H23ClN4O3 and a molecular weight of 402.88 g/mol. Its IUPAC name is 5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide
PubChem CID24736716
Molecular FormulaC20H23ClN4O3
Molecular Weight402.88 g/mol
Exact Mass402.15
IUPAC Name5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide
SMILESO=C(NCc1ccco1)N1CCC(NC(=O)N2CCc3cc(Cl)ccc32)CC1
InChIInChI=1S/C20H23ClN4O3/c21-15-3-4-18-14(12-15)5-10-25(18)20(27)23-16-6-8-24(9-7-16)19(26)22-13-17-2-1-11-28-17/h1-4,11-12,16H,5-10,13H2,(H,22,26)(H,23,27)
InChIKeyQYSVDUABNHMJHP-UHFFFAOYSA-N
XLogP3.38
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.88
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide?
The IUPAC name of 5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide (CID 24736716) is 5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for 5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for 5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide is O=C(NCc1ccco1)N1CCC(NC(=O)N2CCc3cc(Cl)ccc32)CC1.
What is the InChIKey of 5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide?
The InChIKey is QYSVDUABNHMJHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN4O3/c21-15-3-4-18-14(12-15)5-10-25(18)20(27)23-16-6-8-24(9-7-16)19(26)22-13-17-2-1-11-28-17/h1-4,11-12,16H,5-10,13H2,(H,22,26)(H,23,27).
What are the key properties of 5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide?
5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide has a molecular weight of 402.88 g/mol, XLogP of 3.38, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[1-(furan-2-ylmethylcarbamoyl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 24736716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).