N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide

C17H25N3O — CID 79158396

IUPACN-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide
SMILESCC1CCCN(C(=O)NCCC2CNc3ccccc32)C1
InChIInChI=1S/C17H25N3O/c1-13-5-4-10-20(12-13)17(21)18-9-8-14-11-19-16-7-3-2-6-15(14)16/h2-3,6-7,13-14,19H,4-5,8-12H2,1H3,(H,18,21)
InChIKeyZVHQMYPBNGSBOG-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.03
Rot. Bonds3

About N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide

N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide (PubChem CID 79158396) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide
PubChem CID79158396
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC NameN-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide
SMILESCC1CCCN(C(=O)NCCC2CNc3ccccc32)C1
InChIInChI=1S/C17H25N3O/c1-13-5-4-10-20(12-13)17(21)18-9-8-14-11-19-16-7-3-2-6-15(14)16/h2-3,6-7,13-14,19H,4-5,8-12H2,1H3,(H,18,21)
InChIKeyZVHQMYPBNGSBOG-UHFFFAOYSA-N
XLogP3.03
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-2-methylcyclopentane-1-carboxamide
CID 107176784
3-[(3-methylpiperidin-1-yl)methyl]-2,3-dihydro-1H-indole
CID 80567119
N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-2-propylpentanamide
CID 82985554
tert-butyl N-[2-[(3S)-2,3-dihydro-1H-indol-3-yl]ethyl]carbamate
CID 40546938
N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-2-methoxy-2-methylpropanamide
CID 103019631
N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-1-methylpyrazole-3-carboxamide
CID 103117423
N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-2-fluorobenzamide
CID 24700732
N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]octanamide
CID 43125233
N-ethyl-3-methylpiperidine-1-carboxamide
CID 89048200
N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-2-(2-fluorophenyl)acetamide
CID 24709286
(3R)-3-methyl-N-[2-[(S)-phenylsulfinyl]ethyl]piperidine-1-carboxamide
CID 97317437
N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-2,3-dimethylbenzamide
CID 24709751

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide?
The IUPAC name of N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide (CID 79158396) is N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide?
The canonical SMILES for N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide is CC1CCCN(C(=O)NCCC2CNc3ccccc32)C1.
What is the InChIKey of N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide?
The InChIKey is ZVHQMYPBNGSBOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-13-5-4-10-20(12-13)17(21)18-9-8-14-11-19-16-7-3-2-6-15(14)16/h2-3,6-7,13-14,19H,4-5,8-12H2,1H3,(H,18,21).
What are the key properties of N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide?
N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide has a molecular weight of 287.41 g/mol, XLogP of 3.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-3-methylpiperidine-1-carboxamide is sourced from PubChem (CID 79158396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).