2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide

C15H13FN2O2 — CID 110850476

IUPAC2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide
SMILESO=C(Cc1c[nH]c2cccc(F)c12)NCc1ccco1
InChIInChI=1S/C15H13FN2O2/c16-12-4-1-5-13-15(12)10(8-17-13)7-14(19)18-9-11-3-2-6-20-11/h1-6,8,17H,7,9H2,(H,18,19)
InChIKeyKBVNWTFWSYJXCJ-UHFFFAOYSA-N
MW272.28 g/mol
LogP2.76
Rot. Bonds4

About 2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide

2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide (PubChem CID 110850476) has the molecular formula C15H13FN2O2 and a molecular weight of 272.28 g/mol. Its IUPAC name is 2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide
PubChem CID110850476
Molecular FormulaC15H13FN2O2
Molecular Weight272.28 g/mol
Exact Mass272.10
IUPAC Name2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide
SMILESO=C(Cc1c[nH]c2cccc(F)c12)NCc1ccco1
InChIInChI=1S/C15H13FN2O2/c16-12-4-1-5-13-15(12)10(8-17-13)7-14(19)18-9-11-3-2-6-20-11/h1-6,8,17H,7,9H2,(H,18,19)
InChIKeyKBVNWTFWSYJXCJ-UHFFFAOYSA-N
XLogP2.76
TPSA58.03 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.28
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1,3-benzodioxol-5-ylmethyl)-2-(4-fluoro-1H-indol-3-yl)acetamide
CID 110851708
2-(2-chloro-6-fluorophenyl)-N-(furan-2-ylmethyl)acetamide
CID 2161159
2-fluoro-N-(furan-2-ylmethyl)-6-hydroxybenzamide
CID 104916403
(3S)-N-(furan-2-ylmethyl)-3-(4-methoxy-1H-indol-3-yl)-3-(2,3,4-trifluorophenyl)propanamide
CID 97266165
N-(furan-2-ylmethyl)-2-naphthalen-1-ylacetamide
CID 823822
2-(2,6-dichlorophenyl)-N-(furan-2-ylmethyl)acetamide
CID 2082030
1-N-[(2-fluorophenyl)methyl]-3-N-(furan-2-ylmethyl)benzene-1,3-dicarboxamide
CID 109053947
N-[(2-fluorophenyl)methyl]-2-(1H-indol-3-yl)acetamide
CID 3562962
8-fluoro-N-(furan-2-ylmethyl)quinoline-2-carboxamide
CID 110464521
N-(furan-2-ylmethyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 31848406
N-[2-(4-fluoro-1H-indol-3-yl)ethyl]-3,5-bis(hydroxymethyl)benzamide
CID 167960853
2-N-[2-(2-fluorophenyl)ethyl]-6-N-(furan-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 109097096

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide (CID 110850476) is 2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide is O=C(Cc1c[nH]c2cccc(F)c12)NCc1ccco1.
What is the InChIKey of 2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide?
The InChIKey is KBVNWTFWSYJXCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2O2/c16-12-4-1-5-13-15(12)10(8-17-13)7-14(19)18-9-11-3-2-6-20-11/h1-6,8,17H,7,9H2,(H,18,19).
What are the key properties of 2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide?
2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide has a molecular weight of 272.28 g/mol, XLogP of 2.76, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-1H-indol-3-yl)-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 110850476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).