N-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide

C15H20N2O2 — CID 76893380

IUPACN-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide
SMILESCN(C(=O)C1Cc2ccccc2N1)C1CCOCC1
InChIInChI=1S/C15H20N2O2/c1-17(12-6-8-19-9-7-12)15(18)14-10-11-4-2-3-5-13(11)16-14/h2-5,12,14,16H,6-10H2,1H3
InChIKeyGEGNWSLUZQWNLA-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.66
Rot. Bonds2

About N-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide

N-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide (PubChem CID 76893380) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide
PubChem CID76893380
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide
SMILESCN(C(=O)C1Cc2ccccc2N1)C1CCOCC1
InChIInChI=1S/C15H20N2O2/c1-17(12-6-8-19-9-7-12)15(18)14-10-11-4-2-3-5-13(11)16-14/h2-5,12,14,16H,6-10H2,1H3
InChIKeyGEGNWSLUZQWNLA-UHFFFAOYSA-N
XLogP1.66
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 ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide?
The IUPAC name of N-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide (CID 76893380) is N-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide.
What is the SMILES notation for N-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide?
The canonical SMILES for N-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide is CN(C(=O)C1Cc2ccccc2N1)C1CCOCC1.
What is the InChIKey of N-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide?
The InChIKey is GEGNWSLUZQWNLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-17(12-6-8-19-9-7-12)15(18)14-10-11-4-2-3-5-13(11)16-14/h2-5,12,14,16H,6-10H2,1H3.
What are the key properties of N-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide?
N-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(oxan-4-yl)-2,3-dihydro-1H-indole-2-carboxamide is sourced from PubChem (CID 76893380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).