N-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide

C24H19N3O3 — CID 110303963

IUPACN-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide
SMILESO=C(Nc1ccc2c(c1)N(C(=O)c1ccco1)CC2)c1cccc(-n2cccc2)c1
InChIInChI=1S/C24H19N3O3/c28-23(18-5-3-6-20(15-18)26-11-1-2-12-26)25-19-9-8-17-10-13-27(21(17)16-19)24(29)22-7-4-14-30-22/h1-9,11-12,14-16H,10,13H2,(H,25,28)
InChIKeyFGCGQKSRFCVFNH-UHFFFAOYSA-N
MW397.43 g/mol
LogP4.53
Rot. Bonds4

About N-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide

N-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide (PubChem CID 110303963) has the molecular formula C24H19N3O3 and a molecular weight of 397.43 g/mol. Its IUPAC name is N-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide.

Molecular Properties

Compound NameN-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide
PubChem CID110303963
Molecular FormulaC24H19N3O3
Molecular Weight397.43 g/mol
Exact Mass397.14
IUPAC NameN-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide
SMILESO=C(Nc1ccc2c(c1)N(C(=O)c1ccco1)CC2)c1cccc(-n2cccc2)c1
InChIInChI=1S/C24H19N3O3/c28-23(18-5-3-6-20(15-18)26-11-1-2-12-26)25-19-9-8-17-10-13-27(21(17)16-19)24(29)22-7-4-14-30-22/h1-9,11-12,14-16H,10,13H2,(H,25,28)
InChIKeyFGCGQKSRFCVFNH-UHFFFAOYSA-N
XLogP4.53
TPSA67.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.43
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide?
The IUPAC name of N-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide (CID 110303963) is N-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide.
What is the SMILES notation for N-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide?
The canonical SMILES for N-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide is O=C(Nc1ccc2c(c1)N(C(=O)c1ccco1)CC2)c1cccc(-n2cccc2)c1.
What is the InChIKey of N-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide?
The InChIKey is FGCGQKSRFCVFNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3O3/c28-23(18-5-3-6-20(15-18)26-11-1-2-12-26)25-19-9-8-17-10-13-27(21(17)16-19)24(29)22-7-4-14-30-22/h1-9,11-12,14-16H,10,13H2,(H,25,28).
What are the key properties of N-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide?
N-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide has a molecular weight of 397.43 g/mol, XLogP of 4.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-carbonyl)-2,3-dihydroindol-6-yl]-3-pyrrol-1-ylbenzamide is sourced from PubChem (CID 110303963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).