5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide

C22H26FN3O2 — CID 110621734

IUPAC5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide
SMILESCc1[nH]c2ccc(F)cc2c1C(=O)NCC(c1ccco1)N1CCC(C)CC1
InChIInChI=1S/C22H26FN3O2/c1-14-7-9-26(10-8-14)19(20-4-3-11-28-20)13-24-22(27)21-15(2)25-18-6-5-16(23)12-17(18)21/h3-6,11-12,14,19,25H,7-10,13H2,1-2H3,(H,24,27)
InChIKeyQMMUJMNHZGQWFF-UHFFFAOYSA-N
MW383.47 g/mol
LogP4.41
Rot. Bonds5

About 5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide

5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide (PubChem CID 110621734) has the molecular formula C22H26FN3O2 and a molecular weight of 383.47 g/mol. Its IUPAC name is 5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide
PubChem CID110621734
Molecular FormulaC22H26FN3O2
Molecular Weight383.47 g/mol
Exact Mass383.20
IUPAC Name5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide
SMILESCc1[nH]c2ccc(F)cc2c1C(=O)NCC(c1ccco1)N1CCC(C)CC1
InChIInChI=1S/C22H26FN3O2/c1-14-7-9-26(10-8-14)19(20-4-3-11-28-20)13-24-22(27)21-15(2)25-18-6-5-16(23)12-17(18)21/h3-6,11-12,14,19,25H,7-10,13H2,1-2H3,(H,24,27)
InChIKeyQMMUJMNHZGQWFF-UHFFFAOYSA-N
XLogP4.41
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.47
LogP ≤ 54.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide with MolForge

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Related Compounds

4-bromo-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]benzamide;hydrochloride
CID 52985470
5-acetyl-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide
CID 131920266
2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide
CID 110889006
N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-3-pyrrol-1-ylbenzamide
CID 110302591
N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2,3-dihydropyrazolo[5,1-b][1,3]oxazole-6-carboxamide
CID 91959829
N-[(2R)-2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 26834379
3-chloro-N-[(2R)-2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-1-benzothiophene-2-carboxamide
CID 26834359
5-fluoro-2-methyl-N-[1-(1-phenylethyl)piperidin-4-yl]-1H-indole-3-carboxamide
CID 13490832
N-[2-(cyclopropylamino)-2-oxoethyl]-5-fluoro-2-methyl-1H-indole-3-carboxamide
CID 110625091
7-fluoro-N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-2-oxo-1H-quinoline-3-carboxamide
CID 110621241
2,4-difluoro-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-6-hydroxybenzamide
CID 86861584
N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 32687068

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide?
The IUPAC name of 5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide (CID 110621734) is 5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide.
What is the SMILES notation for 5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide?
The canonical SMILES for 5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide is Cc1[nH]c2ccc(F)cc2c1C(=O)NCC(c1ccco1)N1CCC(C)CC1.
What is the InChIKey of 5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide?
The InChIKey is QMMUJMNHZGQWFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26FN3O2/c1-14-7-9-26(10-8-14)19(20-4-3-11-28-20)13-24-22(27)21-15(2)25-18-6-5-16(23)12-17(18)21/h3-6,11-12,14,19,25H,7-10,13H2,1-2H3,(H,24,27).
What are the key properties of 5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide?
5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide has a molecular weight of 383.47 g/mol, XLogP of 4.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-[2-(furan-2-yl)-2-(4-methylpiperidin-1-yl)ethyl]-2-methyl-1H-indole-3-carboxamide is sourced from PubChem (CID 110621734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).