N-[(6-fluoro-1H-indol-5-yl)methyl]acetamide

C11H11FN2O — CID 145002042

IUPACN-[(6-fluoro-1H-indol-5-yl)methyl]acetamide
SMILESCC(=O)NCc1cc2cc[nH]c2cc1F
InChIInChI=1S/C11H11FN2O/c1-7(15)14-6-9-4-8-2-3-13-11(8)5-10(9)12/h2-5,13H,6H2,1H3,(H,14,15)
InChIKeyZXVIMKLYKRBSNR-UHFFFAOYSA-N
MW206.22 g/mol
LogP1.94
Rot. Bonds2

About N-[(6-fluoro-1H-indol-5-yl)methyl]acetamide

N-[(6-fluoro-1H-indol-5-yl)methyl]acetamide (PubChem CID 145002042) has the molecular formula C11H11FN2O and a molecular weight of 206.22 g/mol. Its IUPAC name is N-[(6-fluoro-1H-indol-5-yl)methyl]acetamide.

Molecular Properties

Compound NameN-[(6-fluoro-1H-indol-5-yl)methyl]acetamide
PubChem CID145002042
Molecular FormulaC11H11FN2O
Molecular Weight206.22 g/mol
Exact Mass206.09
IUPAC NameN-[(6-fluoro-1H-indol-5-yl)methyl]acetamide
SMILESCC(=O)NCc1cc2cc[nH]c2cc1F
InChIInChI=1S/C11H11FN2O/c1-7(15)14-6-9-4-8-2-3-13-11(8)5-10(9)12/h2-5,13H,6H2,1H3,(H,14,15)
InChIKeyZXVIMKLYKRBSNR-UHFFFAOYSA-N
XLogP1.94
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.22
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-(6-fluoro-1H-indol-5-yl)ethanamine
CID 82410055
N-[(2-fluorophenyl)methyl]-1H-indole-6-carboxamide
CID 39717434
5-[[4-(1-acetylpyrrolidin-2-yl)phenyl]methyl]-N-[(6-fluoro-1H-indol-5-yl)methyl]pyridine-3-carboxamide
CID 118212803
[6-(acetyloxymethyl)-1H-indol-5-yl]methyl acetate
CID 57245491
1-[4-(6-fluoro-1H-indol-5-yl)phenyl]ethanone
CID 130459975
6-[[4-[(6-fluoro-1H-indol-5-yl)methylcarbamoyl]-2-pyridinyl]methyl]-3-methylquinoline-8-carboxamide
CID 118665428
N-[(2,5-difluorophenyl)methyl]-3-(1H-indol-6-yl)propanamide
CID 71840774
3-chloro-6-methylquinoline;N-[(6-fluoro-3-methyl-1H-indol-5-yl)methyl]acetamide;methane
CID 160774883
N-[4-(1H-indol-5-yl)but-3-enyl]acetamide
CID 170488817
N-[4-(1H-indol-6-yl)but-3-enyl]acetamide
CID 170488820
5-ethyl-6-methyl-1H-indole
CID 89488982
N-[(4-ethyl-2,3-difluorophenyl)methyl]acetamide
CID 123262796

Frequently Asked Questions

What is the IUPAC name of N-[(6-fluoro-1H-indol-5-yl)methyl]acetamide?
The IUPAC name of N-[(6-fluoro-1H-indol-5-yl)methyl]acetamide (CID 145002042) is N-[(6-fluoro-1H-indol-5-yl)methyl]acetamide.
What is the SMILES notation for N-[(6-fluoro-1H-indol-5-yl)methyl]acetamide?
The canonical SMILES for N-[(6-fluoro-1H-indol-5-yl)methyl]acetamide is CC(=O)NCc1cc2cc[nH]c2cc1F.
What is the InChIKey of N-[(6-fluoro-1H-indol-5-yl)methyl]acetamide?
The InChIKey is ZXVIMKLYKRBSNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O/c1-7(15)14-6-9-4-8-2-3-13-11(8)5-10(9)12/h2-5,13H,6H2,1H3,(H,14,15).
What are the key properties of N-[(6-fluoro-1H-indol-5-yl)methyl]acetamide?
N-[(6-fluoro-1H-indol-5-yl)methyl]acetamide has a molecular weight of 206.22 g/mol, XLogP of 1.94, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-fluoro-1H-indol-5-yl)methyl]acetamide is sourced from PubChem (CID 145002042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).