(3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone

C16H19FN2O — CID 47151027

IUPAC(3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone
SMILESCC1CC(C)CN(C(=O)c2cc3c(F)cccc3[nH]2)C1
InChIInChI=1S/C16H19FN2O/c1-10-6-11(2)9-19(8-10)16(20)15-7-12-13(17)4-3-5-14(12)18-15/h3-5,7,10-11,18H,6,8-9H2,1-2H3
InChIKeyRSNLKRFSWYBVDH-UHFFFAOYSA-N
MW274.34 g/mol
LogP3.43
Rot. Bonds1

About (3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone

(3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone (PubChem CID 47151027) has the molecular formula C16H19FN2O and a molecular weight of 274.34 g/mol. Its IUPAC name is (3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone.

Molecular Properties

Compound Name(3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone
PubChem CID47151027
Molecular FormulaC16H19FN2O
Molecular Weight274.34 g/mol
Exact Mass274.15
IUPAC Name(3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone
SMILESCC1CC(C)CN(C(=O)c2cc3c(F)cccc3[nH]2)C1
InChIInChI=1S/C16H19FN2O/c1-10-6-11(2)9-19(8-10)16(20)15-7-12-13(17)4-3-5-14(12)18-15/h3-5,7,10-11,18H,6,8-9H2,1-2H3
InChIKeyRSNLKRFSWYBVDH-UHFFFAOYSA-N
XLogP3.43
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone 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

[(9aS)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl]-(4-fluoro-1H-indol-2-yl)methanone
CID 95590024
(2,6-difluorophenyl)-[(3R,5S)-3,5-dimethylpiperidin-1-yl]methanone
CID 898638
[1-(4-fluoro-1H-indole-2-carbonyl)piperidin-4-yl]-(4-methoxyphenyl)methanone
CID 33366935
4-fluoro-N-(4-methylcyclohexyl)-1H-indole-2-carboxamide
CID 47151029
(4-fluoro-1H-indol-2-yl)-[4-(2-phenylethoxy)piperidin-1-yl]methanone
CID 71884116
1-(4,5-dimethyl-1H-indole-2-carbonyl)-5-methylpiperidine-3-carboxylic acid
CID 122117522
(4-methoxy-1H-indol-2-yl)-[(3R)-3-methylpiperidin-1-yl]methanone
CID 138496983
(4-fluoro-1H-indol-2-yl)-[4-[hydroxy-(1-methylimidazol-2-yl)methyl]piperidin-1-yl]methanone
CID 154795263
[(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]-(4-fluoro-1H-indol-2-yl)methanone
CID 95580375
(4-fluoro-1H-indol-2-yl)-[3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)piperidin-1-yl]methanone
CID 134003167
[3-[(4-aminopyrimidin-2-yl)methyl-methylamino]pyrrolidin-1-yl]-(4-fluoro-1H-indol-2-yl)methanone
CID 128971681
3-[(2R)-1-(4-fluoro-1H-indole-2-carbonyl)piperidin-2-yl]propanoic acid
CID 124701352

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone?
The IUPAC name of (3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone (CID 47151027) is (3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone.
What is the SMILES notation for (3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone?
The canonical SMILES for (3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone is CC1CC(C)CN(C(=O)c2cc3c(F)cccc3[nH]2)C1.
What is the InChIKey of (3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone?
The InChIKey is RSNLKRFSWYBVDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2O/c1-10-6-11(2)9-19(8-10)16(20)15-7-12-13(17)4-3-5-14(12)18-15/h3-5,7,10-11,18H,6,8-9H2,1-2H3.
What are the key properties of (3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone?
(3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone has a molecular weight of 274.34 g/mol, XLogP of 3.43, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethylpiperidin-1-yl)-(4-fluoro-1H-indol-2-yl)methanone is sourced from PubChem (CID 47151027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).