2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide

C18H23FN2O — CID 134005288

IUPAC2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide
SMILESCc1[nH]c2ccc(F)cc2c1CC(=O)NC1CCCC(C)C1
InChIInChI=1S/C18H23FN2O/c1-11-4-3-5-14(8-11)21-18(22)10-15-12(2)20-17-7-6-13(19)9-16(15)17/h6-7,9,11,14,20H,3-5,8,10H2,1-2H3,(H,21,22)
InChIKeyOEYBUELUALRNCH-UHFFFAOYSA-N
MW302.39 g/mol
LogP3.85
Rot. Bonds3

About 2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide

2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide (PubChem CID 134005288) has the molecular formula C18H23FN2O and a molecular weight of 302.39 g/mol. Its IUPAC name is 2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide
PubChem CID134005288
Molecular FormulaC18H23FN2O
Molecular Weight302.39 g/mol
Exact Mass302.18
IUPAC Name2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide
SMILESCc1[nH]c2ccc(F)cc2c1CC(=O)NC1CCCC(C)C1
InChIInChI=1S/C18H23FN2O/c1-11-4-3-5-14(8-11)21-18(22)10-15-12(2)20-17-7-6-13(19)9-16(15)17/h6-7,9,11,14,20H,3-5,8,10H2,1-2H3,(H,21,22)
InChIKeyOEYBUELUALRNCH-UHFFFAOYSA-N
XLogP3.85
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.39
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

N-(3-methylcyclohexyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 134005284
2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-[(3-hydroxycyclohexyl)methyl]acetamide
CID 111460381
N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(5-fluoro-2-methyl-1H-indol-3-yl)acetamide
CID 86934094
2-(5-bromo-2-methyl-1H-indol-3-yl)-N-cycloheptylacetamide
CID 38702160
2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-[(2R,3S,4S)-3-hydroxy-2-(hydroxymethyl)oxan-4-yl]acetamide
CID 146046730
2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 31883592
N-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide
CID 113212089
2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(4-methylphenyl)acetamide
CID 31855827
N-(3,5-dimethylphenyl)-2-(5-fluoro-2-methyl-1H-indol-3-yl)acetamide
CID 31901245
2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-prop-2-enylacetamide
CID 31899230
N-[2-(cyclohexylamino)-2-oxoethyl]-5-fluoro-2-methyl-1H-indole-3-carboxamide
CID 110625213
N-[(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(5-fluoro-2-methyl-1H-indol-3-yl)acetamide
CID 74251445

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide?
The IUPAC name of 2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide (CID 134005288) is 2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide?
The canonical SMILES for 2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide is Cc1[nH]c2ccc(F)cc2c1CC(=O)NC1CCCC(C)C1.
What is the InChIKey of 2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide?
The InChIKey is OEYBUELUALRNCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23FN2O/c1-11-4-3-5-14(8-11)21-18(22)10-15-12(2)20-17-7-6-13(19)9-16(15)17/h6-7,9,11,14,20H,3-5,8,10H2,1-2H3,(H,21,22).
What are the key properties of 2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide?
2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide has a molecular weight of 302.39 g/mol, XLogP of 3.85, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide is sourced from PubChem (CID 134005288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).