(6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone

C15H19FN2O — CID 103494882

IUPAC(6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone
SMILESCC1CCCN(C(=O)N2CCc3ccc(F)cc32)C1
InChIInChI=1S/C15H19FN2O/c1-11-3-2-7-17(10-11)15(19)18-8-6-12-4-5-13(16)9-14(12)18/h4-5,9,11H,2-3,6-8,10H2,1H3
InChIKeyIPZNMKUKKYYZCI-UHFFFAOYSA-N
MW262.33 g/mol
LogP3.04
Rot. Bonds

About (6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone

(6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone (PubChem CID 103494882) has the molecular formula C15H19FN2O and a molecular weight of 262.33 g/mol. Its IUPAC name is (6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone
PubChem CID103494882
Molecular FormulaC15H19FN2O
Molecular Weight262.33 g/mol
Exact Mass262.15
IUPAC Name(6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone
SMILESCC1CCCN(C(=O)N2CCc3ccc(F)cc32)C1
InChIInChI=1S/C15H19FN2O/c1-11-3-2-7-17(10-11)15(19)18-8-6-12-4-5-13(16)9-14(12)18/h4-5,9,11H,2-3,6-8,10H2,1H3
InChIKeyIPZNMKUKKYYZCI-UHFFFAOYSA-N
XLogP3.04
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(3S)-1-(6-fluoro-2,3-dihydroindole-1-carbonyl)piperidine-3-carboxylic acid
CID 103499981
2-[1-(6-fluoro-2,3-dihydroindole-1-carbonyl)pyrrolidin-3-yl]acetic acid
CID 103499932
1-(6-fluoro-2,3-dihydroindole-1-carbonyl)-3-methylpyrrolidine-2-carboxylic acid
CID 103500021
(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-(3-methylpiperidin-1-yl)methanone
CID 115581852
(6-fluoro-2,3-dihydroindol-1-yl)-pyrrolidin-2-ylmethanone
CID 113235710
1-(2,3-dihydroindol-1-yl)-2-(3-methylpiperidin-1-yl)ethane-1,2-dione
CID 47335819
3-(6-fluoro-2,3-dihydroindole-1-carbonyl)cyclohexane-1-carboxylic acid
CID 103953312
2-amino-1-(6-fluoro-2,3-dihydroindol-1-yl)ethanone
CID 103796139
[1-(aminomethyl)-4-methylcyclohexyl]-(6-fluoro-2,3-dihydroindol-1-yl)methanone
CID 103495287
1-(3-methylpiperidine-1-carbonyl)-3,4-dihydro-2H-1-benzazepin-5-one
CID 114336661
(4-methyl-2,3-dihydroquinoxalin-1-yl)-(3-methylpiperidin-1-yl)methanone
CID 116656081
(7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)-(3-methylpiperidin-1-yl)methanone
CID 79159479

Frequently Asked Questions

What is the IUPAC name of (6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone?
The IUPAC name of (6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone (CID 103494882) is (6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone.
What is the SMILES notation for (6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone?
The canonical SMILES for (6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone is CC1CCCN(C(=O)N2CCc3ccc(F)cc32)C1.
What is the InChIKey of (6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone?
The InChIKey is IPZNMKUKKYYZCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O/c1-11-3-2-7-17(10-11)15(19)18-8-6-12-4-5-13(16)9-14(12)18/h4-5,9,11H,2-3,6-8,10H2,1H3.
What are the key properties of (6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone?
(6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone has a molecular weight of 262.33 g/mol, XLogP of 3.04, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6-fluoro-2,3-dihydroindol-1-yl)-(3-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 103494882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).