2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone

C15H20N2O2 — CID 119673107

IUPAC2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone
SMILESCOC1(C(=O)N2CCc3ccccc32)CCNCC1
InChIInChI=1S/C15H20N2O2/c1-19-15(7-9-16-10-8-15)14(18)17-11-6-12-4-2-3-5-13(12)17/h2-5,16H,6-11H2,1H3
InChIKeyLNWAXBBNNGDMRA-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.34
Rot. Bonds2

About 2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone

2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone (PubChem CID 119673107) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone.

Molecular Properties

Compound Name2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone
PubChem CID119673107
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone
SMILESCOC1(C(=O)N2CCc3ccccc32)CCNCC1
InChIInChI=1S/C15H20N2O2/c1-19-15(7-9-16-10-8-15)14(18)17-11-6-12-4-2-3-5-13(12)17/h2-5,16H,6-11H2,1H3
InChIKeyLNWAXBBNNGDMRA-UHFFFAOYSA-N
XLogP1.34
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dihydroindol-1-yl-[(3S)-3-(methoxymethyl)pyrrolidin-3-yl]methanone
CID 129465608
N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-4-methoxypiperidine-4-carboxamide
CID 119761237
1,3-dihydroisoindol-2-yl-(4-methoxypiperidin-4-yl)methanone;hydrochloride
CID 119777882
(4-methoxypiperidin-4-yl)-(1-methyl-3,5-dihydro-2H-1,4-benzodiazepin-4-yl)methanone
CID 119876960
2,3-dihydroindol-1-yl-[1-(4-methylphenyl)cyclopropyl]methanone
CID 113198266
4-(2,3-dihydroindole-1-carbonyl)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
CID 2946417
(1R,4R)-4-(2,3-dihydroindole-1-carbonyl)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
CID 6543989
2,3-dihydroindol-1-yl-[1-(4-methylphenyl)sulfonylcyclopropyl]methanone
CID 4305804
methyl 3-(2,3-dihydroindol-1-yl)-3-oxopropanoate
CID 8990559
(4-aminooxan-4-yl)-(2,3-dihydroindol-1-yl)methanone
CID 113280547
(4-methoxypiperidin-4-yl)-(2-methyl-3-phenylpyrrolidin-1-yl)methanone
CID 119807354
N-[1-(2-bromophenyl)pyrrolidin-3-yl]-4-methoxypiperidine-4-carboxamide
CID 119884408

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone?
The IUPAC name of 2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone (CID 119673107) is 2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone.
What is the SMILES notation for 2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone?
The canonical SMILES for 2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone is COC1(C(=O)N2CCc3ccccc32)CCNCC1.
What is the InChIKey of 2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone?
The InChIKey is LNWAXBBNNGDMRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-19-15(7-9-16-10-8-15)14(18)17-11-6-12-4-2-3-5-13(12)17/h2-5,16H,6-11H2,1H3.
What are the key properties of 2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone?
2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone has a molecular weight of 260.34 g/mol, XLogP of 1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroindol-1-yl-(4-methoxypiperidin-4-yl)methanone is sourced from PubChem (CID 119673107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).