N-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide

C15H20N2O2 — CID 102711803

IUPACN-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide
SMILESCCCC(C)N(C)C(=O)c1ccc2c(c1)NC(=O)C2
InChIInChI=1S/C15H20N2O2/c1-4-5-10(2)17(3)15(19)12-7-6-11-9-14(18)16-13(11)8-12/h6-8,10H,4-5,9H2,1-3H3,(H,16,18)
InChIKeyIHHICHBABFRTHT-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.44
Rot. Bonds4

About N-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide

N-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide (PubChem CID 102711803) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide.

Molecular Properties

Compound NameN-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide
PubChem CID102711803
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide
SMILESCCCC(C)N(C)C(=O)c1ccc2c(c1)NC(=O)C2
InChIInChI=1S/C15H20N2O2/c1-4-5-10(2)17(3)15(19)12-7-6-11-9-14(18)16-13(11)8-12/h6-8,10H,4-5,9H2,1-3H3,(H,16,18)
InChIKeyIHHICHBABFRTHT-UHFFFAOYSA-N
XLogP2.44
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide?
The IUPAC name of N-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide (CID 102711803) is N-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide.
What is the SMILES notation for N-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide?
The canonical SMILES for N-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide is CCCC(C)N(C)C(=O)c1ccc2c(c1)NC(=O)C2.
What is the InChIKey of N-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide?
The InChIKey is IHHICHBABFRTHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-5-10(2)17(3)15(19)12-7-6-11-9-14(18)16-13(11)8-12/h6-8,10H,4-5,9H2,1-3H3,(H,16,18).
What are the key properties of N-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide?
N-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-oxo-N-pentan-2-yl-1,3-dihydroindole-6-carboxamide is sourced from PubChem (CID 102711803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).