7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one

C15H20N2O — CID 84631458

IUPAC7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one
SMILESCc1cccc2c1NC(=O)C2CC1CCCNC1
InChIInChI=1S/C15H20N2O/c1-10-4-2-6-12-13(15(18)17-14(10)12)8-11-5-3-7-16-9-11/h2,4,6,11,13,16H,3,5,7-9H2,1H3,(H,17,18)
InChIKeyGOSGSILXIOWIRR-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.42
Rot. Bonds2

About 7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one

7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one (PubChem CID 84631458) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one
PubChem CID84631458
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one
SMILESCc1cccc2c1NC(=O)C2CC1CCCNC1
InChIInChI=1S/C15H20N2O/c1-10-4-2-6-12-13(15(18)17-14(10)12)8-11-5-3-7-16-9-11/h2,4,6,11,13,16H,3,5,7-9H2,1H3,(H,17,18)
InChIKeyGOSGSILXIOWIRR-UHFFFAOYSA-N
XLogP2.42
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-cyclohexylethyl)-7-methyl-1,3-dihydroindol-2-one
CID 106987031
3-cyclohexyl-7-methyl-1,3-dihydroindol-2-one
CID 82081633
3-[(2,3-dimethylphenyl)methyl]piperidine
CID 62548706
1-(2,3-dimethylphenyl)-2-piperidin-3-ylethanone
CID 116564167
3-[(3-chlorophenyl)methyl]-7-methyl-1,3-dihydroindol-2-one
CID 43912430
(3R)-3-[(2-bromophenyl)methyl]-7-methyl-1,3-dihydroindol-2-one
CID 98160364
7-methyl-3-[(2,4,5-trimethoxyphenyl)methyl]-1,3-dihydroindol-2-one
CID 43912363
3-[(2-methylphenoxy)methyl]piperidine
CID 18524094
3-[(2-bromo-5-methoxyphenyl)methyl]-7-methyl-1,3-dihydroindol-2-one
CID 43912366
7-methyl-3-[(4-propoxyphenyl)methyl]-1,3-dihydroindol-2-one
CID 43912377
N-ethyl-2-methyl-N-(piperidin-3-ylmethyl)benzenesulfonamide
CID 106631091
ethane;3-(2-methylphenyl)piperidine
CID 144655647

Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one?
The IUPAC name of 7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one (CID 84631458) is 7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one?
The canonical SMILES for 7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one is Cc1cccc2c1NC(=O)C2CC1CCCNC1.
What is the InChIKey of 7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one?
The InChIKey is GOSGSILXIOWIRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-10-4-2-6-12-13(15(18)17-14(10)12)8-11-5-3-7-16-9-11/h2,4,6,11,13,16H,3,5,7-9H2,1H3,(H,17,18).
What are the key properties of 7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one?
7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one has a molecular weight of 244.34 g/mol, XLogP of 2.42, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-(piperidin-3-ylmethyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 84631458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).