2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide

C14H17FN2O — CID 63850467

IUPAC2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide
SMILESCC(C)N(C)C(=O)Cn1ccc2cc(F)ccc21
InChIInChI=1S/C14H17FN2O/c1-10(2)16(3)14(18)9-17-7-6-11-8-12(15)4-5-13(11)17/h4-8,10H,9H2,1-3H3
InChIKeyTUDBWNVQWONAJI-UHFFFAOYSA-N
MW248.30 g/mol
LogP2.65
Rot. Bonds3

About 2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide

2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide (PubChem CID 63850467) has the molecular formula C14H17FN2O and a molecular weight of 248.30 g/mol. Its IUPAC name is 2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide
PubChem CID63850467
Molecular FormulaC14H17FN2O
Molecular Weight248.30 g/mol
Exact Mass248.13
IUPAC Name2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide
SMILESCC(C)N(C)C(=O)Cn1ccc2cc(F)ccc21
InChIInChI=1S/C14H17FN2O/c1-10(2)16(3)14(18)9-17-7-6-11-8-12(15)4-5-13(11)17/h4-8,10H,9H2,1-3H3
InChIKeyTUDBWNVQWONAJI-UHFFFAOYSA-N
XLogP2.65
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.30
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Ethanone, 1-(1H-indol-1-yl)-
CID 68470
N-Acetyltryptamine
CID 70547
1-Methylindole
CID 11781
1H-indole-1-propionamide
CID 88755
N-(2-(1H-Indol-3-Yl)Ethyl)Propanamide
CID 216303
1H-Indole-1-acetic acid
CID 90448
(S)-1-(5,6-difluoro-1H-indol-1-yl)propan-2-amine
CID 10330734
(3R)-5-(2-fluorophenyl)-3-(1H-indol-3-ylmethyl)-1-methyl-3H-1,4-benzodiazepin-2-one
CID 656755
N-(2-(5-fluoro-1H-indol-3-yl)ethyl)acetamide
CID 699127
1-methyl-N,N-dimethyltryptamine
CID 25927
2-(1H-indol-1-yl)ethanamine
CID 258690
N-[2-(1H-Indol-3-yl)ethyl]-N-methylacetamide
CID 383154

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide?
The IUPAC name of 2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide (CID 63850467) is 2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide is CC(C)N(C)C(=O)Cn1ccc2cc(F)ccc21.
What is the InChIKey of 2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide?
The InChIKey is TUDBWNVQWONAJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O/c1-10(2)16(3)14(18)9-17-7-6-11-8-12(15)4-5-13(11)17/h4-8,10H,9H2,1-3H3.
What are the key properties of 2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide?
2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide has a molecular weight of 248.30 g/mol, XLogP of 2.65, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoroindol-1-yl)-N-methyl-N-propan-2-ylacetamide is sourced from PubChem (CID 63850467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).