N-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide

C16H24N2O2 — CID 76894437

IUPACN-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide
SMILESCOCCN(CC(C)C)C(=O)C1Cc2ccccc2N1
InChIInChI=1S/C16H24N2O2/c1-12(2)11-18(8-9-20-3)16(19)15-10-13-6-4-5-7-14(13)17-15/h4-7,12,15,17H,8-11H2,1-3H3
InChIKeyXQZWDTJLIZKEAB-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.15
Rot. Bonds6

About N-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide

N-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide (PubChem CID 76894437) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide
PubChem CID76894437
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide
SMILESCOCCN(CC(C)C)C(=O)C1Cc2ccccc2N1
InChIInChI=1S/C16H24N2O2/c1-12(2)11-18(8-9-20-3)16(19)15-10-13-6-4-5-7-14(13)17-15/h4-7,12,15,17H,8-11H2,1-3H3
InChIKeyXQZWDTJLIZKEAB-UHFFFAOYSA-N
XLogP2.15
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide (CID 76894437) is N-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide is COCCN(CC(C)C)C(=O)C1Cc2ccccc2N1.
What is the InChIKey of N-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide?
The InChIKey is XQZWDTJLIZKEAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12(2)11-18(8-9-20-3)16(19)15-10-13-6-4-5-7-14(13)17-15/h4-7,12,15,17H,8-11H2,1-3H3.
What are the key properties of N-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide?
N-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.15, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(2-methylpropyl)-2,3-dihydro-1H-indole-2-carboxamide is sourced from PubChem (CID 76894437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).