N-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide

C17H24N2O — CID 63130111

IUPACN-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide
SMILESCN(C(=O)C1(C)CCCNC1)C1CCc2ccccc21
InChIInChI=1S/C17H24N2O/c1-17(10-5-11-18-12-17)16(20)19(2)15-9-8-13-6-3-4-7-14(13)15/h3-4,6-7,15,18H,5,8-12H2,1-2H3
InChIKeyMGSXFLUYTVPPPB-UHFFFAOYSA-N
MW272.39 g/mol
LogP2.52
Rot. Bonds2

About N-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide

N-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide (PubChem CID 63130111) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide
PubChem CID63130111
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC NameN-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide
SMILESCN(C(=O)C1(C)CCCNC1)C1CCc2ccccc21
InChIInChI=1S/C17H24N2O/c1-17(10-5-11-18-12-17)16(20)19(2)15-9-8-13-6-3-4-7-14(13)15/h3-4,6-7,15,18H,5,8-12H2,1-2H3
InChIKeyMGSXFLUYTVPPPB-UHFFFAOYSA-N
XLogP2.52
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide (CID 63130111) is N-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide is CN(C(=O)C1(C)CCCNC1)C1CCc2ccccc21.
What is the InChIKey of N-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide?
The InChIKey is MGSXFLUYTVPPPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-17(10-5-11-18-12-17)16(20)19(2)15-9-8-13-6-3-4-7-14(13)15/h3-4,6-7,15,18H,5,8-12H2,1-2H3.
What are the key properties of N-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide?
N-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide has a molecular weight of 272.39 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-1-yl)-N,3-dimethylpiperidine-3-carboxamide is sourced from PubChem (CID 63130111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).