N-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide

C22H19N3O3 — CID 17492691

IUPACN-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide
SMILESCc1cc2ccccc2n1CC(=O)Nc1cccc(NC(=O)c2ccco2)c1
InChIInChI=1S/C22H19N3O3/c1-15-12-16-6-2-3-9-19(16)25(15)14-21(26)23-17-7-4-8-18(13-17)24-22(27)20-10-5-11-28-20/h2-13H,14H2,1H3,(H,23,26)(H,24,27)
InChIKeyMOIRDBAYNFIEIA-UHFFFAOYSA-N
MW373.41 g/mol
LogP4.43
Rot. Bonds5

About N-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide

N-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide (PubChem CID 17492691) has the molecular formula C22H19N3O3 and a molecular weight of 373.41 g/mol. Its IUPAC name is N-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide
PubChem CID17492691
Molecular FormulaC22H19N3O3
Molecular Weight373.41 g/mol
Exact Mass373.14
IUPAC NameN-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide
SMILESCc1cc2ccccc2n1CC(=O)Nc1cccc(NC(=O)c2ccco2)c1
InChIInChI=1S/C22H19N3O3/c1-15-12-16-6-2-3-9-19(16)25(15)14-21(26)23-17-7-4-8-18(13-17)24-22(27)20-10-5-11-28-20/h2-13H,14H2,1H3,(H,23,26)(H,24,27)
InChIKeyMOIRDBAYNFIEIA-UHFFFAOYSA-N
XLogP4.43
TPSA76.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methylindol-1-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]acetamide
CID 47776662
N-(4-bromophenyl)-2-(2-methylindol-1-yl)acetamide
CID 4226117
N-[3-(dimethylsulfamoyl)phenyl]-2-(2-methylindol-1-yl)acetamide
CID 26689900
N-[3-[[2-(heptylamino)acetyl]amino]phenyl]furan-2-carboxamide
CID 54814790
N-[3-(furan-2-carbonylamino)phenyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 3755550
N-[3-[(2-phenylsulfanylacetyl)amino]phenyl]furan-2-carboxamide
CID 1093492
N-[3-[[2-(diethylamino)acetyl]amino]phenyl]furan-2-carboxamide
CID 54813683
2-(2-methylindol-1-yl)-N-(6-methyl-2-pyridinyl)acetamide
CID 4173283
N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]furan-2-carboxamide
CID 1491636
2-chloro-5-[[2-(2-methylindol-1-yl)acetyl]amino]benzamide
CID 30806248
N-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methylindol-1-yl)acetamide
CID 25441973
N-[3-[[2-(4-iodoanilino)-2-oxoethyl]amino]phenyl]furan-2-carboxamide
CID 54843288

Frequently Asked Questions

What is the IUPAC name of N-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide?
The IUPAC name of N-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide (CID 17492691) is N-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide is Cc1cc2ccccc2n1CC(=O)Nc1cccc(NC(=O)c2ccco2)c1.
What is the InChIKey of N-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide?
The InChIKey is MOIRDBAYNFIEIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O3/c1-15-12-16-6-2-3-9-19(16)25(15)14-21(26)23-17-7-4-8-18(13-17)24-22(27)20-10-5-11-28-20/h2-13H,14H2,1H3,(H,23,26)(H,24,27).
What are the key properties of N-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide?
N-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide has a molecular weight of 373.41 g/mol, XLogP of 4.43, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[2-(2-methylindol-1-yl)acetyl]amino]phenyl]furan-2-carboxamide is sourced from PubChem (CID 17492691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).