2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide

C18H20ClN3O2 — CID 110621183

IUPAC2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide
SMILESCN(C)C(CNC(=O)Cc1c[nH]c2ccc(Cl)cc12)c1ccco1
InChIInChI=1S/C18H20ClN3O2/c1-22(2)16(17-4-3-7-24-17)11-21-18(23)8-12-10-20-15-6-5-13(19)9-14(12)15/h3-7,9-10,16,20H,8,11H2,1-2H3,(H,21,23)
InChIKeyXEZFLCDPNQUMCW-UHFFFAOYSA-N
MW345.83 g/mol
LogP3.38
Rot. Bonds6

About 2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide

2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide (PubChem CID 110621183) has the molecular formula C18H20ClN3O2 and a molecular weight of 345.83 g/mol. Its IUPAC name is 2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide
PubChem CID110621183
Molecular FormulaC18H20ClN3O2
Molecular Weight345.83 g/mol
Exact Mass345.12
IUPAC Name2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide
SMILESCN(C)C(CNC(=O)Cc1c[nH]c2ccc(Cl)cc12)c1ccco1
InChIInChI=1S/C18H20ClN3O2/c1-22(2)16(17-4-3-7-24-17)11-21-18(23)8-12-10-20-15-6-5-13(19)9-14(12)15/h3-7,9-10,16,20H,8,11H2,1-2H3,(H,21,23)
InChIKeyXEZFLCDPNQUMCW-UHFFFAOYSA-N
XLogP3.38
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.83
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-(1H-indol-3-yl)butanamide
CID 2481341
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-fluorophenyl)acetamide
CID 18588939
2-(5-chloro-1H-indol-3-yl)-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide
CID 111441170
2-(5-chloro-1H-indol-3-yl)-N-[(4-chlorophenyl)methyl]acetamide
CID 113209503
2-(5-chloro-1H-indol-3-yl)-N-[2-(2-hydroxyethyl)pentyl]acetamide
CID 111697345
6-chloro-N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-oxochromene-2-carboxamide
CID 26834060
N-(3-acetamidopropyl)-2-(5-chloro-1H-indol-3-yl)acetamide
CID 110630730
4-chloro-N-[4-[[2-(dimethylamino)-2-(furan-2-yl)ethyl]amino]-4-oxobutyl]benzamide
CID 51145123
2-(5-chloro-1H-indol-3-yl)-N-methoxyacetamide
CID 110611810
2-(5-chloro-1H-indol-3-yl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]acetamide
CID 110625376
2-(5-chloro-1H-indol-3-yl)-N-[2-(3-chlorophenyl)ethyl]acetamide
CID 113209520
3-(2-chlorophenyl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]propanamide
CID 43005118

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide?
The IUPAC name of 2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide (CID 110621183) is 2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide is CN(C)C(CNC(=O)Cc1c[nH]c2ccc(Cl)cc12)c1ccco1.
What is the InChIKey of 2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide?
The InChIKey is XEZFLCDPNQUMCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClN3O2/c1-22(2)16(17-4-3-7-24-17)11-21-18(23)8-12-10-20-15-6-5-13(19)9-14(12)15/h3-7,9-10,16,20H,8,11H2,1-2H3,(H,21,23).
What are the key properties of 2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide?
2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide has a molecular weight of 345.83 g/mol, XLogP of 3.38, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-1H-indol-3-yl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]acetamide is sourced from PubChem (CID 110621183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).